/opt/conda_envs/mace-new/lib/python3.10/site-packages/e3nn/o3/_wigner.py:10: FutureWarning: You are using `torch.load` with `weights_only=False` (the current default value), which uses the default pickle module implicitly. It is possible to construct malicious pickle data which will execute arbitrary code during unpickling (See https://github.com/pytorch/pytorch/blob/main/SECURITY.md#untrusted-models for more details). In a future release, the default value for `weights_only` will be flipped to `True`. This limits the functions that could be executed during unpickling. Arbitrary objects will no longer be allowed to be loaded via this mode unless they are explicitly allowlisted by the user via `torch.serialization.add_safe_globals`. We recommend you start setting `weights_only=True` for any use case where you don't have full control of the loaded file. Please open an issue on GitHub for any issues related to this experimental feature. _Jd, _W3j_flat, _W3j_indices = torch.load(os.path.join(os.path.dirname(__file__), 'constants.pt')) cuequivariance or cuequivariance_torch is not available. Cuequivariance acceleration will be disabled. 2026-03-20 18:42:39.244 INFO: ===========VERIFYING SETTINGS=========== 2026-03-20 18:42:39.244 INFO: MACE version: 0.3.15 2026-03-20 18:42:39.716 INFO: CUDA version: 12.1, CUDA device: 0 /opt/conda_envs/mace-new/lib/python3.10/site-packages/mace/cli/run_train.py:168: FutureWarning: You are using `torch.load` with `weights_only=False` (the current default value), which uses the default pickle module implicitly. It is possible to construct malicious pickle data which will execute arbitrary code during unpickling (See https://github.com/pytorch/pytorch/blob/main/SECURITY.md#untrusted-models for more details). In a future release, the default value for `weights_only` will be flipped to `True`. This limits the functions that could be executed during unpickling. Arbitrary objects will no longer be allowed to be loaded via this mode unless they are explicitly allowlisted by the user via `torch.serialization.add_safe_globals`. We recommend you start setting `weights_only=True` for any use case where you don't have full control of the loaded file. Please open an issue on GitHub for any issues related to this experimental feature. model_foundation = torch.load( 2026-03-20 18:42:40.079 INFO: Using foundation model MACE-matpes-pbe-omat-ft.model as initial checkpoint. 2026-03-20 18:42:40.082 INFO: ===========LOADING INPUT DATA=========== 2026-03-20 18:42:40.082 INFO: Using heads: ['Default'] 2026-03-20 18:42:40.082 INFO: Using the key specifications to parse data: 2026-03-20 18:42:40.082 INFO: Default: KeySpecification(info_keys={'energy': 'REF_energy', 'stress': 'REF_stress', 'virials': 'REF_virials', 'dipole': 'dipole', 'head': 'head', 'elec_temp': 'elec_temp', 'total_charge': 'total_charge', 'polarizability': 'polarizability', 'total_spin': 'total_spin'}, arrays_keys={'forces': 'REF_forces', 'charges': 'REF_charges'}) 2026-03-20 18:42:40.082 INFO: ============= Processing head Default =========== 2026-03-20 18:42:41.716 INFO: Training set 1/1 [energy: 1572, stress: 0, virials: 0, dipole components: 0, head: 1572, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 1572, charges: 0] 2026-03-20 18:42:41.725 INFO: Total Training set [energy: 1572, stress: 0, virials: 0, dipole components: 0, head: 1572, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 1572, charges: 0] 2026-03-20 18:42:41.725 INFO: No validation set provided, splitting training data instead. 2026-03-20 18:42:41.725 INFO: Using random 10% of training set for validation with indices saved in: ./MACE_valid_indices_3.txt 2026-03-20 18:42:41.733 INFO: Random Split Training set [energy: 1415, stress: 0, virials: 0, dipole components: 0, head: 1415, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 1415, charges: 0] 2026-03-20 18:42:41.734 INFO: Random Split Validation set [energy: 157, stress: 0, virials: 0, dipole components: 0, head: 157, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 157, charges: 0] 2026-03-20 18:42:41.920 INFO: Test set 1/1 [energy: 175, stress: 0, virials: 0, dipole components: 0, head: 175, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 175, charges: 0] 2026-03-20 18:42:41.921 INFO: Total Test set [energy: 175, stress: 0, virials: 0, dipole components: 0, head: 175, elec_temp: 0, total_charge: 0, polarizability: 0, total_spin: 0, forces: 175, charges: 0] 2026-03-20 18:42:41.921 INFO: Total number of configurations: train=1415, valid=157, tests=[Default_Default: 175], 2026-03-20 18:42:41.966 INFO: Atomic Numbers used: [np.int64(1), np.int64(6)] 2026-03-20 18:42:41.966 INFO: Isolated Atomic Energies (E0s) not in training file, using command line argument 2026-03-20 18:42:41.966 INFO: Computing average Atomic Energies using least squares regression 2026-03-20 18:42:41.973 INFO: Atomic Energies used (z: eV) for head Default: {1: -11.986904840960273, 6: -8.995257102752642} 2026-03-20 18:42:41.973 INFO: Processing datasets for head 'Default' 2026-03-20 18:42:44.937 INFO: Combining 1 list datasets for head 'Default' 2026-03-20 18:42:45.247 INFO: Head 'Default' training dataset size: 1415 2026-03-20 18:42:45.248 INFO: Computing average number of neighbors 2026-03-20 18:42:48.106 INFO: Average number of neighbors: 40.38329809571554 2026-03-20 18:42:48.106 INFO: During training the following quantities will be reported: energy, forces 2026-03-20 18:42:48.106 INFO: ===========MODEL DETAILS=========== 2026-03-20 18:42:50.418 INFO: Loading FOUNDATION model 2026-03-20 18:42:50.420 INFO: Using filtered elements: [np.int64(1), np.int64(6)] 2026-03-20 18:42:50.420 INFO: Model configuration extracted from foundation model 2026-03-20 18:42:50.420 INFO: Using weighted loss function for fine-tuning 2026-03-20 18:42:50.420 INFO: Message passing with hidden irreps 128x0e+128x1o) 2026-03-20 18:42:50.420 INFO: 2 layers, each with correlation order: 3 (body order: 4) and spherical harmonics up to: l=3 2026-03-20 18:42:50.420 INFO: Radial cutoff: 6.0 A (total receptive field for each atom: 12.0 A) 2026-03-20 18:42:50.420 INFO: Distance transform for radial basis functions: Agnesi /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( /home/pragya/.local/lib/python3.10/site-packages/torch/jit/_check.py:178: UserWarning: The TorchScript type system doesn't support instance-level annotations on empty non-base types in `__init__`. Instead, either 1) use a type annotation in the class body, or 2) wrap the type in `torch.jit.Attribute`. warnings.warn( 2026-03-20 18:42:52.212 INFO: Total number of parameters: 655534 2026-03-20 18:42:52.212 INFO: 2026-03-20 18:42:52.212 INFO: ===========OPTIMIZER INFORMATION=========== 2026-03-20 18:42:52.212 INFO: Using ADAM as parameter optimizer 2026-03-20 18:42:52.212 INFO: Batch size: 2 2026-03-20 18:42:52.212 INFO: Using Exponential Moving Average with decay: 0.99 2026-03-20 18:42:52.212 INFO: Number of gradient updates: 1132000 2026-03-20 18:42:52.212 INFO: Learning rate: 0.001, weight decay: 5e-07 2026-03-20 18:42:52.212 INFO: WeightedEnergyForcesLoss(energy_weight=1.000, forces_weight=5.000) 2026-03-20 18:42:52.214 WARNING: No SWA checkpoint found, while SWA is enabled. Compare the swa_start parameter and the latest checkpoint. 2026-03-20 18:42:52.214 INFO: Loading checkpoint: ./checkpoints/MACE_run-3_epoch-981.pt /opt/conda_envs/mace-new/lib/python3.10/site-packages/mace/tools/checkpoint.py:187: FutureWarning: You are using `torch.load` with `weights_only=False` (the current default value), which uses the default pickle module implicitly. It is possible to construct malicious pickle data which will execute arbitrary code during unpickling (See https://github.com/pytorch/pytorch/blob/main/SECURITY.md#untrusted-models for more details). In a future release, the default value for `weights_only` will be flipped to `True`. This limits the functions that could be executed during unpickling. Arbitrary objects will no longer be allowed to be loaded via this mode unless they are explicitly allowlisted by the user via `torch.serialization.add_safe_globals`. We recommend you start setting `weights_only=True` for any use case where you don't have full control of the loaded file. Please open an issue on GitHub for any issues related to this experimental feature. torch.load(f=checkpoint_info.path, map_location=device), 2026-03-20 18:42:52.255 INFO: Using gradient clipping with tolerance=10.000 2026-03-20 18:42:52.255 INFO: 2026-03-20 18:42:52.255 INFO: ===========TRAINING=========== 2026-03-20 18:42:52.255 INFO: Started training, reporting errors on validation set 2026-03-20 18:42:52.255 INFO: Loss metrics on validation set 2026-03-20 18:43:08.372 INFO: Initial: head: Default, loss=0.00043288, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.18 meV / A 2026-03-20 18:49:25.511 INFO: Epoch 981: head: Default, loss=0.00072870, RMSE_E_per_atom= 2.23 meV, RMSE_F= 37.96 meV / A 2026-03-20 18:55:40.094 INFO: Epoch 982: head: Default, loss=0.00043689, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.32 meV / A 2026-03-20 19:01:54.351 INFO: Epoch 983: head: Default, loss=0.00069256, RMSE_E_per_atom= 2.24 meV, RMSE_F= 37.00 meV / A 2026-03-20 19:08:08.644 INFO: Epoch 984: head: Default, loss=0.00043795, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.35 meV / A 2026-03-20 19:14:22.719 INFO: Epoch 985: head: Default, loss=0.00067281, RMSE_E_per_atom= 2.21 meV, RMSE_F= 36.47 meV / A 2026-03-20 19:20:36.980 INFO: Epoch 986: head: Default, loss=0.00043973, RMSE_E_per_atom= 2.20 meV, RMSE_F= 29.41 meV / A 2026-03-20 19:26:50.839 INFO: Epoch 987: head: Default, loss=0.00067672, RMSE_E_per_atom= 2.23 meV, RMSE_F= 36.57 meV / A 2026-03-20 19:33:04.549 INFO: Epoch 988: head: Default, loss=0.00044412, RMSE_E_per_atom= 2.21 meV, RMSE_F= 29.56 meV / A 2026-03-20 19:39:18.579 INFO: Epoch 989: head: Default, loss=0.00063329, RMSE_E_per_atom= 2.27 meV, RMSE_F= 35.37 meV / A 2026-03-20 19:45:32.529 INFO: Epoch 990: head: Default, loss=0.00053363, RMSE_E_per_atom= 2.13 meV, RMSE_F= 32.44 meV / A 2026-03-20 19:51:47.494 INFO: Epoch 991: head: Default, loss=0.00058536, RMSE_E_per_atom= 2.28 meV, RMSE_F= 33.99 meV / A 2026-03-20 19:58:02.043 INFO: Epoch 992: head: Default, loss=0.00045088, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.79 meV / A 2026-03-20 20:04:16.525 INFO: Epoch 993: head: Default, loss=0.00062867, RMSE_E_per_atom= 2.20 meV, RMSE_F= 35.24 meV / A 2026-03-20 20:10:30.986 INFO: Epoch 994: head: Default, loss=0.00043421, RMSE_E_per_atom= 2.19 meV, RMSE_F= 29.23 meV / A 2026-03-20 20:16:44.934 INFO: Epoch 995: head: Default, loss=0.00067024, RMSE_E_per_atom= 2.20 meV, RMSE_F= 36.40 meV / A 2026-03-20 20:22:59.301 INFO: Epoch 996: head: Default, loss=0.00044841, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.71 meV / A 2026-03-20 20:29:13.594 INFO: Epoch 997: head: Default, loss=0.00065802, RMSE_E_per_atom= 2.20 meV, RMSE_F= 36.06 meV / A 2026-03-20 20:35:27.695 INFO: Epoch 998: head: Default, loss=0.00044941, RMSE_E_per_atom= 2.19 meV, RMSE_F= 29.74 meV / A 2026-03-20 20:41:42.353 INFO: Epoch 999: head: Default, loss=0.00064560, RMSE_E_per_atom= 2.20 meV, RMSE_F= 35.71 meV / A 2026-03-20 20:47:56.503 INFO: Epoch 1000: head: Default, loss=0.00045441, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.91 meV / A 2026-03-20 20:54:10.254 INFO: Epoch 1001: head: Default, loss=0.00043400, RMSE_E_per_atom= 2.22 meV, RMSE_F= 29.22 meV / A 2026-03-20 21:00:23.843 INFO: Epoch 1002: head: Default, loss=0.00044694, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.66 meV / A 2026-03-20 21:06:37.167 INFO: Epoch 1003: head: Default, loss=0.00063166, RMSE_E_per_atom= 2.20 meV, RMSE_F= 35.32 meV / A 2026-03-20 21:12:50.615 INFO: Epoch 1004: head: Default, loss=0.00043921, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.40 meV / A 2026-03-20 21:19:04.312 INFO: Epoch 1005: head: Default, loss=0.00066339, RMSE_E_per_atom= 2.23 meV, RMSE_F= 36.21 meV / A 2026-03-20 21:25:18.391 INFO: Epoch 1006: head: Default, loss=0.00044374, RMSE_E_per_atom= 2.20 meV, RMSE_F= 29.55 meV / A 2026-03-20 21:31:32.320 INFO: Epoch 1007: head: Default, loss=0.00064236, RMSE_E_per_atom= 2.22 meV, RMSE_F= 35.62 meV / A 2026-03-20 21:37:46.103 INFO: Epoch 1008: head: Default, loss=0.00044638, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.64 meV / A 2026-03-20 21:43:59.985 INFO: Epoch 1009: head: Default, loss=0.00064893, RMSE_E_per_atom= 2.21 meV, RMSE_F= 35.81 meV / A 2026-03-20 21:50:14.265 INFO: Epoch 1010: head: Default, loss=0.00044283, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.52 meV / A 2026-03-20 21:56:29.035 INFO: Epoch 1011: head: Default, loss=0.00066028, RMSE_E_per_atom= 2.24 meV, RMSE_F= 36.12 meV / A 2026-03-20 22:02:43.590 INFO: Epoch 1012: head: Default, loss=0.00044782, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.69 meV / A 2026-03-20 22:08:57.743 INFO: Epoch 1013: head: Default, loss=0.00048205, RMSE_E_per_atom= 2.29 meV, RMSE_F= 30.82 meV / A 2026-03-20 22:15:11.562 INFO: Epoch 1014: head: Default, loss=0.00049732, RMSE_E_per_atom= 2.13 meV, RMSE_F= 31.30 meV / A 2026-03-20 22:21:25.358 INFO: Epoch 1015: head: Default, loss=0.00062783, RMSE_E_per_atom= 2.20 meV, RMSE_F= 35.22 meV / A 2026-03-20 22:27:39.514 INFO: Epoch 1016: head: Default, loss=0.00044261, RMSE_E_per_atom= 2.19 meV, RMSE_F= 29.51 meV / A 2026-03-20 22:33:53.742 INFO: Epoch 1017: head: Default, loss=0.00066627, RMSE_E_per_atom= 2.20 meV, RMSE_F= 36.29 meV / A 2026-03-20 22:40:08.027 INFO: Epoch 1018: head: Default, loss=0.00044442, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.57 meV / A 2026-03-20 22:46:22.422 INFO: Epoch 1019: head: Default, loss=0.00064798, RMSE_E_per_atom= 2.19 meV, RMSE_F= 35.78 meV / A 2026-03-20 22:52:36.469 INFO: Epoch 1020: head: Default, loss=0.00043443, RMSE_E_per_atom= 2.13 meV, RMSE_F= 29.24 meV / A 2026-03-20 22:58:49.941 INFO: Epoch 1021: head: Default, loss=0.00066473, RMSE_E_per_atom= 2.19 meV, RMSE_F= 36.25 meV / A 2026-03-20 23:05:03.959 INFO: Epoch 1022: head: Default, loss=0.00044612, RMSE_E_per_atom= 2.16 meV, RMSE_F= 29.63 meV / A 2026-03-20 23:11:18.217 INFO: Epoch 1023: head: Default, loss=0.00065774, RMSE_E_per_atom= 2.20 meV, RMSE_F= 36.05 meV / A 2026-03-20 23:17:32.657 INFO: Epoch 1024: head: Default, loss=0.00044675, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.65 meV / A 2026-03-20 23:23:46.845 INFO: Epoch 1025: head: Default, loss=0.00063967, RMSE_E_per_atom= 2.21 meV, RMSE_F= 35.55 meV / A 2026-03-20 23:30:01.023 INFO: Epoch 1026: head: Default, loss=0.00044732, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.67 meV / A 2026-03-20 23:36:14.906 INFO: Epoch 1027: head: Default, loss=0.00064296, RMSE_E_per_atom= 2.20 meV, RMSE_F= 35.64 meV / A 2026-03-20 23:42:28.912 INFO: Epoch 1028: head: Default, loss=0.00044561, RMSE_E_per_atom= 2.18 meV, RMSE_F= 29.61 meV / A 2026-03-20 23:48:42.902 INFO: Epoch 1029: head: Default, loss=0.00065544, RMSE_E_per_atom= 2.21 meV, RMSE_F= 35.99 meV / A 2026-03-20 23:54:57.018 INFO: Epoch 1030: head: Default, loss=0.00047387, RMSE_E_per_atom= 2.16 meV, RMSE_F= 30.55 meV / A 2026-03-21 00:01:10.976 INFO: Epoch 1031: head: Default, loss=0.00061801, RMSE_E_per_atom= 2.26 meV, RMSE_F= 34.94 meV / A 2026-03-21 00:07:24.562 INFO: Epoch 1032: head: Default, loss=0.00044943, RMSE_E_per_atom= 2.19 meV, RMSE_F= 29.74 meV / A 2026-03-21 00:13:38.168 INFO: Epoch 1033: head: Default, loss=0.00064680, RMSE_E_per_atom= 2.21 meV, RMSE_F= 35.75 meV / A 2026-03-21 00:19:51.663 INFO: Epoch 1034: head: Default, loss=0.00044736, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.67 meV / A 2026-03-21 00:26:05.200 INFO: Epoch 1035: head: Default, loss=0.00044417, RMSE_E_per_atom= 2.23 meV, RMSE_F= 29.57 meV / A 2026-03-21 00:32:18.546 INFO: Epoch 1036: head: Default, loss=0.00048556, RMSE_E_per_atom= 2.12 meV, RMSE_F= 30.93 meV / A 2026-03-21 00:38:31.695 INFO: Epoch 1037: head: Default, loss=0.00062919, RMSE_E_per_atom= 2.23 meV, RMSE_F= 35.25 meV / A 2026-03-21 00:44:45.844 INFO: Epoch 1038: head: Default, loss=0.00043461, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.24 meV / A 2026-03-21 00:50:59.834 INFO: Epoch 1039: head: Default, loss=0.00064584, RMSE_E_per_atom= 2.17 meV, RMSE_F= 35.72 meV / A 2026-03-21 00:57:13.752 INFO: Epoch 1040: head: Default, loss=0.00043697, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.32 meV / A 2026-03-21 01:03:27.768 INFO: Epoch 1041: head: Default, loss=0.00068860, RMSE_E_per_atom= 2.21 meV, RMSE_F= 36.90 meV / A 2026-03-21 01:09:42.071 INFO: Epoch 1042: head: Default, loss=0.00043486, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.25 meV / A 2026-03-21 01:15:56.425 INFO: Epoch 1043: head: Default, loss=0.00058681, RMSE_E_per_atom= 2.25 meV, RMSE_F= 34.03 meV / A 2026-03-21 01:22:10.311 INFO: Epoch 1044: head: Default, loss=0.00044626, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.64 meV / A 2026-03-21 01:28:24.279 INFO: Epoch 1045: head: Default, loss=0.00063884, RMSE_E_per_atom= 2.25 meV, RMSE_F= 35.53 meV / A 2026-03-21 01:34:38.408 INFO: Epoch 1046: head: Default, loss=0.00054008, RMSE_E_per_atom= 2.13 meV, RMSE_F= 32.64 meV / A 2026-03-21 01:40:53.172 INFO: Epoch 1047: head: Default, loss=0.00066253, RMSE_E_per_atom= 2.18 meV, RMSE_F= 36.19 meV / A 2026-03-21 01:47:07.126 INFO: Epoch 1048: head: Default, loss=0.00044486, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.59 meV / A 2026-03-21 01:53:21.338 INFO: Epoch 1049: head: Default, loss=0.00065989, RMSE_E_per_atom= 2.21 meV, RMSE_F= 36.11 meV / A 2026-03-21 01:59:35.408 INFO: Epoch 1050: head: Default, loss=0.00043946, RMSE_E_per_atom= 2.16 meV, RMSE_F= 29.40 meV / A 2026-03-21 02:05:49.713 INFO: Epoch 1051: head: Default, loss=0.00051597, RMSE_E_per_atom= 2.23 meV, RMSE_F= 31.89 meV / A 2026-03-21 02:12:04.277 INFO: Epoch 1052: head: Default, loss=0.00045246, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.84 meV / A 2026-03-21 02:18:18.590 INFO: Epoch 1053: head: Default, loss=0.00044785, RMSE_E_per_atom= 2.20 meV, RMSE_F= 29.69 meV / A 2026-03-21 02:24:32.810 INFO: Epoch 1054: head: Default, loss=0.00043295, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.19 meV / A 2026-03-21 02:30:47.047 INFO: Epoch 1055: head: Default, loss=0.00056139, RMSE_E_per_atom= 2.23 meV, RMSE_F= 33.28 meV / A 2026-03-21 02:37:01.392 INFO: Epoch 1056: head: Default, loss=0.00043300, RMSE_E_per_atom= 2.12 meV, RMSE_F= 29.19 meV / A 2026-03-21 02:43:15.546 INFO: Epoch 1057: head: Default, loss=0.00058311, RMSE_E_per_atom= 2.24 meV, RMSE_F= 33.93 meV / A 2026-03-21 02:49:29.673 INFO: Epoch 1058: head: Default, loss=0.00043378, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.21 meV / A 2026-03-21 02:55:43.984 INFO: Epoch 1059: head: Default, loss=0.00059882, RMSE_E_per_atom= 2.20 meV, RMSE_F= 34.39 meV / A 2026-03-21 03:01:57.906 INFO: Epoch 1060: head: Default, loss=0.00043322, RMSE_E_per_atom= 2.16 meV, RMSE_F= 29.19 meV / A 2026-03-21 03:08:11.959 INFO: Epoch 1061: head: Default, loss=0.00064139, RMSE_E_per_atom= 2.17 meV, RMSE_F= 35.60 meV / A 2026-03-21 03:14:25.699 INFO: Epoch 1062: head: Default, loss=0.00043298, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.19 meV / A 2026-03-21 03:20:39.390 INFO: Epoch 1063: head: Default, loss=0.00063950, RMSE_E_per_atom= 2.22 meV, RMSE_F= 35.55 meV / A 2026-03-21 03:26:52.949 INFO: Epoch 1064: head: Default, loss=0.00047329, RMSE_E_per_atom= 2.08 meV, RMSE_F= 30.53 meV / A 2026-03-21 03:33:06.631 INFO: Epoch 1065: head: Default, loss=0.00064216, RMSE_E_per_atom= 2.16 meV, RMSE_F= 35.62 meV / A 2026-03-21 03:39:20.974 INFO: Epoch 1066: head: Default, loss=0.00043745, RMSE_E_per_atom= 2.12 meV, RMSE_F= 29.34 meV / A 2026-03-21 03:45:36.838 INFO: Epoch 1067: head: Default, loss=0.00064554, RMSE_E_per_atom= 2.17 meV, RMSE_F= 35.72 meV / A 2026-03-21 03:51:52.869 INFO: Epoch 1068: head: Default, loss=0.00056008, RMSE_E_per_atom= 2.18 meV, RMSE_F= 33.24 meV / A 2026-03-21 03:58:08.586 INFO: Epoch 1069: head: Default, loss=0.00065781, RMSE_E_per_atom= 2.15 meV, RMSE_F= 36.06 meV / A 2026-03-21 04:04:24.270 INFO: Epoch 1070: head: Default, loss=0.00043287, RMSE_E_per_atom= 2.16 meV, RMSE_F= 29.18 meV / A 2026-03-21 04:10:40.165 INFO: Epoch 1071: head: Default, loss=0.00064879, RMSE_E_per_atom= 2.15 meV, RMSE_F= 35.81 meV / A 2026-03-21 04:16:55.979 INFO: Epoch 1072: head: Default, loss=0.00045637, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.98 meV / A 2026-03-21 04:23:11.583 INFO: Epoch 1073: head: Default, loss=0.00063991, RMSE_E_per_atom= 2.16 meV, RMSE_F= 35.56 meV / A 2026-03-21 04:29:27.073 INFO: Epoch 1074: head: Default, loss=0.00043306, RMSE_E_per_atom= 2.17 meV, RMSE_F= 29.19 meV / A 2026-03-21 04:35:43.052 INFO: Epoch 1075: head: Default, loss=0.00062269, RMSE_E_per_atom= 2.18 meV, RMSE_F= 35.07 meV / A 2026-03-21 04:41:58.867 INFO: Epoch 1076: head: Default, loss=0.00043324, RMSE_E_per_atom= 2.13 meV, RMSE_F= 29.20 meV / A 2026-03-21 04:48:14.466 INFO: Epoch 1077: head: Default, loss=0.00063323, RMSE_E_per_atom= 2.14 meV, RMSE_F= 35.37 meV / A 2026-03-21 04:54:30.205 INFO: Epoch 1078: head: Default, loss=0.00046219, RMSE_E_per_atom= 2.10 meV, RMSE_F= 30.17 meV / A 2026-03-21 05:00:45.860 INFO: Epoch 1079: head: Default, loss=0.00065282, RMSE_E_per_atom= 2.16 meV, RMSE_F= 35.92 meV / A 2026-03-21 05:07:01.581 INFO: Epoch 1080: head: Default, loss=0.00043262, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.17 meV / A 2026-03-21 05:13:16.876 INFO: Epoch 1081: head: Default, loss=0.00058672, RMSE_E_per_atom= 2.23 meV, RMSE_F= 34.03 meV / A 2026-03-21 05:19:32.744 INFO: Epoch 1082: head: Default, loss=0.00043187, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.15 meV / A 2026-03-21 05:25:48.542 INFO: Epoch 1083: head: Default, loss=0.00064307, RMSE_E_per_atom= 2.17 meV, RMSE_F= 35.65 meV / A 2026-03-21 05:32:04.596 INFO: Epoch 1084: head: Default, loss=0.00043289, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.19 meV / A 2026-03-21 05:38:20.507 INFO: Epoch 1085: head: Default, loss=0.00066146, RMSE_E_per_atom= 2.15 meV, RMSE_F= 36.16 meV / A 2026-03-21 05:44:36.268 INFO: Epoch 1086: head: Default, loss=0.00043253, RMSE_E_per_atom= 2.12 meV, RMSE_F= 29.17 meV / A 2026-03-21 05:50:51.940 INFO: Epoch 1087: head: Default, loss=0.00065893, RMSE_E_per_atom= 2.17 meV, RMSE_F= 36.09 meV / A 2026-03-21 05:57:07.555 INFO: Epoch 1088: head: Default, loss=0.00043874, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.38 meV / A 2026-03-21 06:03:23.313 INFO: Epoch 1089: head: Default, loss=0.00063445, RMSE_E_per_atom= 2.14 meV, RMSE_F= 35.40 meV / A 2026-03-21 06:09:39.294 INFO: Epoch 1090: head: Default, loss=0.00045931, RMSE_E_per_atom= 2.06 meV, RMSE_F= 30.07 meV / A 2026-03-21 06:15:54.922 INFO: Epoch 1091: head: Default, loss=0.00068105, RMSE_E_per_atom= 2.16 meV, RMSE_F= 36.69 meV / A 2026-03-21 06:22:10.611 INFO: Epoch 1092: head: Default, loss=0.00043473, RMSE_E_per_atom= 2.13 meV, RMSE_F= 29.25 meV / A 2026-03-21 06:28:26.172 INFO: Epoch 1093: head: Default, loss=0.00059332, RMSE_E_per_atom= 2.13 meV, RMSE_F= 34.23 meV / A 2026-03-21 06:34:41.980 INFO: Epoch 1094: head: Default, loss=0.00043227, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.16 meV / A 2026-03-21 06:40:58.119 INFO: Epoch 1095: head: Default, loss=0.00067379, RMSE_E_per_atom= 2.15 meV, RMSE_F= 36.50 meV / A 2026-03-21 06:47:14.192 INFO: Epoch 1096: head: Default, loss=0.00043197, RMSE_E_per_atom= 2.15 meV, RMSE_F= 29.15 meV / A 2026-03-21 06:53:30.407 INFO: Epoch 1097: head: Default, loss=0.00066567, RMSE_E_per_atom= 2.16 meV, RMSE_F= 36.27 meV / A 2026-03-21 06:59:46.492 INFO: Epoch 1098: head: Default, loss=0.00043261, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.18 meV / A 2026-03-21 07:06:02.291 INFO: Epoch 1099: head: Default, loss=0.00068240, RMSE_E_per_atom= 2.19 meV, RMSE_F= 36.73 meV / A 2026-03-21 07:12:18.481 INFO: Epoch 1100: head: Default, loss=0.00061810, RMSE_E_per_atom= 2.29 meV, RMSE_F= 34.94 meV / A 2026-03-21 07:18:34.353 INFO: Epoch 1101: head: Default, loss=0.00064477, RMSE_E_per_atom= 2.18 meV, RMSE_F= 35.69 meV / A 2026-03-21 07:24:50.169 INFO: Epoch 1102: head: Default, loss=0.00052969, RMSE_E_per_atom= 2.11 meV, RMSE_F= 32.32 meV / A 2026-03-21 07:31:06.354 INFO: Epoch 1103: head: Default, loss=0.00064260, RMSE_E_per_atom= 2.18 meV, RMSE_F= 35.63 meV / A 2026-03-21 07:37:22.190 INFO: Epoch 1104: head: Default, loss=0.00043298, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.19 meV / A 2026-03-21 07:43:38.259 INFO: Epoch 1105: head: Default, loss=0.00064337, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.66 meV / A 2026-03-21 07:49:54.343 INFO: Epoch 1106: head: Default, loss=0.00043730, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.33 meV / A 2026-03-21 07:56:10.585 INFO: Epoch 1107: head: Default, loss=0.00063174, RMSE_E_per_atom= 2.15 meV, RMSE_F= 35.33 meV / A 2026-03-21 08:02:26.640 INFO: Epoch 1108: head: Default, loss=0.00043231, RMSE_E_per_atom= 2.14 meV, RMSE_F= 29.16 meV / A 2026-03-21 08:08:42.725 INFO: Epoch 1109: head: Default, loss=0.00066967, RMSE_E_per_atom= 2.16 meV, RMSE_F= 36.38 meV / A 2026-03-21 08:14:58.788 INFO: Epoch 1110: head: Default, loss=0.00043232, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.16 meV / A 2026-03-21 08:21:14.901 INFO: Epoch 1111: head: Default, loss=0.00066684, RMSE_E_per_atom= 2.12 meV, RMSE_F= 36.31 meV / A 2026-03-21 08:27:30.624 INFO: Epoch 1112: head: Default, loss=0.00043236, RMSE_E_per_atom= 2.13 meV, RMSE_F= 29.17 meV / A 2026-03-21 08:33:46.759 INFO: Epoch 1113: head: Default, loss=0.00044279, RMSE_E_per_atom= 2.13 meV, RMSE_F= 29.52 meV / A 2026-03-21 08:40:02.573 INFO: Epoch 1114: head: Default, loss=0.00045513, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.94 meV / A 2026-03-21 08:46:18.616 INFO: Epoch 1115: head: Default, loss=0.00064170, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.61 meV / A 2026-03-21 08:52:34.637 INFO: Epoch 1116: head: Default, loss=0.00059128, RMSE_E_per_atom= 2.36 meV, RMSE_F= 34.16 meV / A 2026-03-21 08:58:50.983 INFO: Epoch 1117: head: Default, loss=0.00064641, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.74 meV / A 2026-03-21 09:05:07.431 INFO: Epoch 1118: head: Default, loss=0.00043313, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.19 meV / A 2026-03-21 09:11:23.736 INFO: Epoch 1119: head: Default, loss=0.00064113, RMSE_E_per_atom= 2.11 meV, RMSE_F= 35.59 meV / A 2026-03-21 09:17:39.498 INFO: Epoch 1120: head: Default, loss=0.00043304, RMSE_E_per_atom= 2.12 meV, RMSE_F= 29.19 meV / A 2026-03-21 09:23:55.024 INFO: Epoch 1121: head: Default, loss=0.00054464, RMSE_E_per_atom= 2.18 meV, RMSE_F= 32.78 meV / A 2026-03-21 09:30:11.013 INFO: Epoch 1122: head: Default, loss=0.00043525, RMSE_E_per_atom= 2.06 meV, RMSE_F= 29.27 meV / A 2026-03-21 09:36:25.938 INFO: Epoch 1123: head: Default, loss=0.00063968, RMSE_E_per_atom= 2.12 meV, RMSE_F= 35.55 meV / A 2026-03-21 09:42:39.892 INFO: Epoch 1124: head: Default, loss=0.00043208, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.16 meV / A 2026-03-21 09:48:53.935 INFO: Epoch 1125: head: Default, loss=0.00065205, RMSE_E_per_atom= 2.19 meV, RMSE_F= 35.90 meV / A 2026-03-21 09:55:07.824 INFO: Epoch 1126: head: Default, loss=0.00043167, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.14 meV / A 2026-03-21 10:01:22.253 INFO: Epoch 1127: head: Default, loss=0.00049111, RMSE_E_per_atom= 2.15 meV, RMSE_F= 31.11 meV / A 2026-03-21 10:07:36.487 INFO: Epoch 1128: head: Default, loss=0.00043272, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.18 meV / A 2026-03-21 10:13:50.558 INFO: Epoch 1129: head: Default, loss=0.00048751, RMSE_E_per_atom= 2.19 meV, RMSE_F= 30.99 meV / A 2026-03-21 10:20:04.731 INFO: Epoch 1130: head: Default, loss=0.00043319, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.19 meV / A 2026-03-21 10:26:19.150 INFO: Epoch 1131: head: Default, loss=0.00064232, RMSE_E_per_atom= 2.17 meV, RMSE_F= 35.63 meV / A 2026-03-21 10:32:33.265 INFO: Epoch 1132: head: Default, loss=0.00043168, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.14 meV / A 2026-03-21 10:38:47.070 INFO: Epoch 1133: head: Default, loss=0.00064849, RMSE_E_per_atom= 2.16 meV, RMSE_F= 35.80 meV / A 2026-03-21 10:45:00.255 INFO: Epoch 1134: head: Default, loss=0.00044117, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.46 meV / A 2026-03-21 10:51:13.263 INFO: Epoch 1135: head: Default, loss=0.00058258, RMSE_E_per_atom= 2.14 meV, RMSE_F= 33.91 meV / A 2026-03-21 10:57:27.123 INFO: Epoch 1136: head: Default, loss=0.00043654, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.31 meV / A 2026-03-21 11:03:41.298 INFO: Epoch 1137: head: Default, loss=0.00062960, RMSE_E_per_atom= 2.18 meV, RMSE_F= 35.27 meV / A 2026-03-21 11:09:55.277 INFO: Epoch 1138: head: Default, loss=0.00043481, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.25 meV / A 2026-03-21 11:16:09.297 INFO: Epoch 1139: head: Default, loss=0.00052917, RMSE_E_per_atom= 2.18 meV, RMSE_F= 32.30 meV / A 2026-03-21 11:22:23.237 INFO: Epoch 1140: head: Default, loss=0.00043471, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.25 meV / A 2026-03-21 11:28:37.216 INFO: Epoch 1141: head: Default, loss=0.00060855, RMSE_E_per_atom= 2.15 meV, RMSE_F= 34.67 meV / A 2026-03-21 11:34:51.027 INFO: Epoch 1142: head: Default, loss=0.00043235, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.17 meV / A 2026-03-21 11:41:04.834 INFO: Epoch 1143: head: Default, loss=0.00052841, RMSE_E_per_atom= 2.26 meV, RMSE_F= 32.28 meV / A 2026-03-21 11:47:18.589 INFO: Epoch 1144: head: Default, loss=0.00043230, RMSE_E_per_atom= 2.12 meV, RMSE_F= 29.17 meV / A 2026-03-21 11:53:32.530 INFO: Epoch 1145: head: Default, loss=0.00063005, RMSE_E_per_atom= 2.14 meV, RMSE_F= 35.28 meV / A 2026-03-21 11:59:46.453 INFO: Epoch 1146: head: Default, loss=0.00043841, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.37 meV / A 2026-03-21 12:06:00.194 INFO: Epoch 1147: head: Default, loss=0.00043297, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.19 meV / A 2026-03-21 12:12:13.880 INFO: Epoch 1148: head: Default, loss=0.00043162, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.14 meV / A 2026-03-21 12:18:27.889 INFO: Epoch 1149: head: Default, loss=0.00052524, RMSE_E_per_atom= 2.16 meV, RMSE_F= 32.18 meV / A 2026-03-21 12:24:41.957 INFO: Epoch 1150: head: Default, loss=0.00043171, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.15 meV / A 2026-03-21 12:30:56.206 INFO: Epoch 1151: head: Default, loss=0.00059448, RMSE_E_per_atom= 2.15 meV, RMSE_F= 34.26 meV / A 2026-03-21 12:37:10.412 INFO: Epoch 1152: head: Default, loss=0.00049779, RMSE_E_per_atom= 2.08 meV, RMSE_F= 31.32 meV / A 2026-03-21 12:43:24.578 INFO: Epoch 1153: head: Default, loss=0.00057511, RMSE_E_per_atom= 2.20 meV, RMSE_F= 33.69 meV / A 2026-03-21 12:49:38.529 INFO: Epoch 1154: head: Default, loss=0.00043393, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.22 meV / A 2026-03-21 12:55:51.879 INFO: Epoch 1155: head: Default, loss=0.00053187, RMSE_E_per_atom= 2.16 meV, RMSE_F= 32.39 meV / A 2026-03-21 13:02:06.241 INFO: Epoch 1156: head: Default, loss=0.00043225, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.16 meV / A 2026-03-21 13:08:20.714 INFO: Epoch 1157: head: Default, loss=0.00062775, RMSE_E_per_atom= 2.16 meV, RMSE_F= 35.22 meV / A 2026-03-21 13:14:35.346 INFO: Epoch 1158: head: Default, loss=0.00043202, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.16 meV / A 2026-03-21 13:20:50.484 INFO: Epoch 1159: head: Default, loss=0.00060755, RMSE_E_per_atom= 2.18 meV, RMSE_F= 34.64 meV / A 2026-03-21 13:27:04.878 INFO: Epoch 1160: head: Default, loss=0.00043279, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.18 meV / A 2026-03-21 13:33:19.744 INFO: Epoch 1161: head: Default, loss=0.00063361, RMSE_E_per_atom= 2.15 meV, RMSE_F= 35.38 meV / A 2026-03-21 13:39:34.550 INFO: Epoch 1162: head: Default, loss=0.00044832, RMSE_E_per_atom= 2.03 meV, RMSE_F= 29.71 meV / A 2026-03-21 13:45:49.462 INFO: Epoch 1163: head: Default, loss=0.00066620, RMSE_E_per_atom= 2.15 meV, RMSE_F= 36.29 meV / A 2026-03-21 13:52:03.959 INFO: Epoch 1164: head: Default, loss=0.00048411, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.89 meV / A 2026-03-21 13:58:18.810 INFO: Epoch 1165: head: Default, loss=0.00056528, RMSE_E_per_atom= 2.16 meV, RMSE_F= 33.40 meV / A 2026-03-21 14:04:33.067 INFO: Epoch 1166: head: Default, loss=0.00043207, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.16 meV / A 2026-03-21 14:10:47.740 INFO: Epoch 1167: head: Default, loss=0.00052195, RMSE_E_per_atom= 2.16 meV, RMSE_F= 32.08 meV / A 2026-03-21 14:17:02.469 INFO: Epoch 1168: head: Default, loss=0.00043169, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.14 meV / A 2026-03-21 14:23:16.550 INFO: Epoch 1169: head: Default, loss=0.00064804, RMSE_E_per_atom= 2.11 meV, RMSE_F= 35.79 meV / A 2026-03-21 14:29:31.033 INFO: Epoch 1170: head: Default, loss=0.00043214, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.16 meV / A 2026-03-21 14:35:45.577 INFO: Epoch 1171: head: Default, loss=0.00063584, RMSE_E_per_atom= 2.10 meV, RMSE_F= 35.44 meV / A 2026-03-21 14:41:59.725 INFO: Epoch 1172: head: Default, loss=0.00043136, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.13 meV / A 2026-03-21 14:48:14.154 INFO: Epoch 1173: head: Default, loss=0.00066943, RMSE_E_per_atom= 2.12 meV, RMSE_F= 36.38 meV / A 2026-03-21 14:54:28.980 INFO: Epoch 1174: head: Default, loss=0.00043197, RMSE_E_per_atom= 2.10 meV, RMSE_F= 29.15 meV / A 2026-03-21 15:00:43.365 INFO: Epoch 1175: head: Default, loss=0.00056757, RMSE_E_per_atom= 2.14 meV, RMSE_F= 33.47 meV / A 2026-03-21 15:06:57.232 INFO: Epoch 1176: head: Default, loss=0.00043189, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 15:13:11.381 INFO: Epoch 1177: head: Default, loss=0.00063754, RMSE_E_per_atom= 2.15 meV, RMSE_F= 35.49 meV / A 2026-03-21 15:19:25.869 INFO: Epoch 1178: head: Default, loss=0.00043182, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 15:25:39.865 INFO: Epoch 1179: head: Default, loss=0.00065555, RMSE_E_per_atom= 2.11 meV, RMSE_F= 35.99 meV / A 2026-03-21 15:31:53.758 INFO: Epoch 1180: head: Default, loss=0.00043222, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.16 meV / A 2026-03-21 15:38:07.656 INFO: Epoch 1181: head: Default, loss=0.00063372, RMSE_E_per_atom= 2.14 meV, RMSE_F= 35.38 meV / A 2026-03-21 15:44:21.480 INFO: Epoch 1182: head: Default, loss=0.00043127, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.13 meV / A 2026-03-21 15:50:34.980 INFO: Epoch 1183: head: Default, loss=0.00064046, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.57 meV / A 2026-03-21 15:56:49.293 INFO: Epoch 1184: head: Default, loss=0.00043206, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.16 meV / A 2026-03-21 16:03:03.770 INFO: Epoch 1185: head: Default, loss=0.00057715, RMSE_E_per_atom= 2.14 meV, RMSE_F= 33.75 meV / A 2026-03-21 16:09:18.154 INFO: Epoch 1186: head: Default, loss=0.00043155, RMSE_E_per_atom= 2.11 meV, RMSE_F= 29.14 meV / A 2026-03-21 16:15:32.222 INFO: Epoch 1187: head: Default, loss=0.00051488, RMSE_E_per_atom= 2.12 meV, RMSE_F= 31.86 meV / A 2026-03-21 16:21:46.568 INFO: Epoch 1188: head: Default, loss=0.00043381, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.22 meV / A 2026-03-21 16:28:00.808 INFO: Epoch 1189: head: Default, loss=0.00063106, RMSE_E_per_atom= 2.12 meV, RMSE_F= 35.31 meV / A 2026-03-21 16:34:14.649 INFO: Epoch 1190: head: Default, loss=0.00043168, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.14 meV / A 2026-03-21 16:40:28.798 INFO: Epoch 1191: head: Default, loss=0.00061828, RMSE_E_per_atom= 2.16 meV, RMSE_F= 34.95 meV / A 2026-03-21 16:46:42.818 INFO: Epoch 1192: head: Default, loss=0.00043034, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.10 meV / A 2026-03-21 16:52:56.669 INFO: Epoch 1193: head: Default, loss=0.00067302, RMSE_E_per_atom= 2.13 meV, RMSE_F= 36.48 meV / A 2026-03-21 16:59:10.821 INFO: Epoch 1194: head: Default, loss=0.00043260, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.18 meV / A 2026-03-21 17:05:24.850 INFO: Epoch 1195: head: Default, loss=0.00067032, RMSE_E_per_atom= 2.19 meV, RMSE_F= 36.40 meV / A 2026-03-21 17:11:38.857 INFO: Epoch 1196: head: Default, loss=0.00043183, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 17:17:52.730 INFO: Epoch 1197: head: Default, loss=0.00065122, RMSE_E_per_atom= 2.11 meV, RMSE_F= 35.88 meV / A 2026-03-21 17:24:06.760 INFO: Epoch 1198: head: Default, loss=0.00043190, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 17:30:20.513 INFO: Epoch 1199: head: Default, loss=0.00065920, RMSE_E_per_atom= 2.20 meV, RMSE_F= 36.09 meV / A 2026-03-21 17:36:34.846 INFO: Epoch 1200: head: Default, loss=0.00043288, RMSE_E_per_atom= 2.06 meV, RMSE_F= 29.19 meV / A 2026-03-21 17:42:48.549 INFO: Epoch 1201: head: Default, loss=0.00065221, RMSE_E_per_atom= 2.15 meV, RMSE_F= 35.90 meV / A 2026-03-21 17:49:02.074 INFO: Epoch 1202: head: Default, loss=0.00043189, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 17:55:16.162 INFO: Epoch 1203: head: Default, loss=0.00064726, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.76 meV / A 2026-03-21 18:01:30.310 INFO: Epoch 1204: head: Default, loss=0.00043156, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.14 meV / A 2026-03-21 18:07:43.964 INFO: Epoch 1205: head: Default, loss=0.00064381, RMSE_E_per_atom= 2.12 meV, RMSE_F= 35.67 meV / A 2026-03-21 18:13:57.718 INFO: Epoch 1206: head: Default, loss=0.00054528, RMSE_E_per_atom= 2.10 meV, RMSE_F= 32.80 meV / A 2026-03-21 18:20:11.680 INFO: Epoch 1207: head: Default, loss=0.00065074, RMSE_E_per_atom= 2.12 meV, RMSE_F= 35.86 meV / A 2026-03-21 18:26:25.582 INFO: Epoch 1208: head: Default, loss=0.00043117, RMSE_E_per_atom= 2.06 meV, RMSE_F= 29.13 meV / A 2026-03-21 18:32:39.502 INFO: Epoch 1209: head: Default, loss=0.00064954, RMSE_E_per_atom= 2.06 meV, RMSE_F= 35.83 meV / A 2026-03-21 18:38:53.425 INFO: Epoch 1210: head: Default, loss=0.00043141, RMSE_E_per_atom= 2.06 meV, RMSE_F= 29.13 meV / A 2026-03-21 18:45:07.624 INFO: Epoch 1211: head: Default, loss=0.00044182, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.49 meV / A 2026-03-21 18:51:21.820 INFO: Epoch 1212: head: Default, loss=0.00043084, RMSE_E_per_atom= 2.06 meV, RMSE_F= 29.12 meV / A 2026-03-21 18:57:35.920 INFO: Epoch 1213: head: Default, loss=0.00065911, RMSE_E_per_atom= 2.15 meV, RMSE_F= 36.09 meV / A 2026-03-21 19:03:50.080 INFO: Epoch 1214: head: Default, loss=0.00043236, RMSE_E_per_atom= 2.04 meV, RMSE_F= 29.17 meV / A 2026-03-21 19:10:04.146 INFO: Epoch 1215: head: Default, loss=0.00062545, RMSE_E_per_atom= 2.14 meV, RMSE_F= 35.15 meV / A 2026-03-21 19:16:18.116 INFO: Epoch 1216: head: Default, loss=0.00043281, RMSE_E_per_atom= 2.01 meV, RMSE_F= 29.19 meV / A 2026-03-21 19:22:33.062 INFO: Epoch 1217: head: Default, loss=0.00064563, RMSE_E_per_atom= 2.09 meV, RMSE_F= 35.72 meV / A 2026-03-21 19:28:47.988 INFO: Epoch 1218: head: Default, loss=0.00043189, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.15 meV / A 2026-03-21 19:35:02.889 INFO: Epoch 1219: head: Default, loss=0.00043052, RMSE_E_per_atom= 2.08 meV, RMSE_F= 29.11 meV / A 2026-03-21 19:41:17.541 INFO: Epoch 1220: head: Default, loss=0.00043173, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.15 meV / A 2026-03-21 19:47:31.655 INFO: Epoch 1221: head: Default, loss=0.00064731, RMSE_E_per_atom= 2.09 meV, RMSE_F= 35.77 meV / A 2026-03-21 19:53:45.984 INFO: Epoch 1222: head: Default, loss=0.00043497, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.26 meV / A 2026-03-21 20:00:01.923 INFO: Epoch 1223: head: Default, loss=0.00065479, RMSE_E_per_atom= 2.10 meV, RMSE_F= 35.97 meV / A 2026-03-21 20:06:18.707 INFO: Epoch 1224: head: Default, loss=0.00043107, RMSE_E_per_atom= 2.04 meV, RMSE_F= 29.12 meV / A 2026-03-21 20:12:35.374 INFO: Epoch 1225: head: Default, loss=0.00064416, RMSE_E_per_atom= 2.11 meV, RMSE_F= 35.68 meV / A 2026-03-21 20:18:51.488 INFO: Epoch 1226: head: Default, loss=0.00043074, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.11 meV / A 2026-03-21 20:25:07.776 INFO: Epoch 1227: head: Default, loss=0.00065325, RMSE_E_per_atom= 2.10 meV, RMSE_F= 35.93 meV / A 2026-03-21 20:31:24.046 INFO: Epoch 1228: head: Default, loss=0.00051899, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.99 meV / A 2026-03-21 20:37:40.330 INFO: Epoch 1229: head: Default, loss=0.00064455, RMSE_E_per_atom= 2.13 meV, RMSE_F= 35.69 meV / A 2026-03-21 20:43:56.218 INFO: Epoch 1230: head: Default, loss=0.00043384, RMSE_E_per_atom= 2.04 meV, RMSE_F= 29.22 meV / A 2026-03-21 20:50:12.184 INFO: Epoch 1231: head: Default, loss=0.00067841, RMSE_E_per_atom= 2.13 meV, RMSE_F= 36.62 meV / A 2026-03-21 20:56:26.728 INFO: Epoch 1232: head: Default, loss=0.00043361, RMSE_E_per_atom= 2.02 meV, RMSE_F= 29.21 meV / A 2026-03-21 21:02:41.048 INFO: Epoch 1233: head: Default, loss=0.00065172, RMSE_E_per_atom= 2.09 meV, RMSE_F= 35.89 meV / A 2026-03-21 21:08:55.121 INFO: Epoch 1234: head: Default, loss=0.00043210, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.16 meV / A 2026-03-21 21:15:09.284 INFO: Epoch 1235: head: Default, loss=0.00064048, RMSE_E_per_atom= 2.08 meV, RMSE_F= 35.58 meV / A 2026-03-21 21:21:23.518 INFO: Epoch 1236: head: Default, loss=0.00043123, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.13 meV / A 2026-03-21 21:27:37.400 INFO: Epoch 1237: head: Default, loss=0.00047524, RMSE_E_per_atom= 2.10 meV, RMSE_F= 30.60 meV / A 2026-03-21 21:33:51.818 INFO: Epoch 1238: head: Default, loss=0.00043904, RMSE_E_per_atom= 2.04 meV, RMSE_F= 29.40 meV / A 2026-03-21 21:40:06.351 INFO: Epoch 1239: head: Default, loss=0.00064397, RMSE_E_per_atom= 2.07 meV, RMSE_F= 35.67 meV / A 2026-03-21 21:46:20.359 INFO: Epoch 1240: head: Default, loss=0.00043196, RMSE_E_per_atom= 2.09 meV, RMSE_F= 29.15 meV / A 2026-03-21 21:52:34.470 INFO: Epoch 1241: head: Default, loss=0.00046436, RMSE_E_per_atom= 2.11 meV, RMSE_F= 30.24 meV / A 2026-03-21 21:58:48.683 INFO: Epoch 1242: head: Default, loss=0.00043303, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.19 meV / A 2026-03-21 22:05:02.562 INFO: Epoch 1243: head: Default, loss=0.00063850, RMSE_E_per_atom= 2.10 meV, RMSE_F= 35.52 meV / A 2026-03-21 22:11:16.865 INFO: Epoch 1244: head: Default, loss=0.00043338, RMSE_E_per_atom= 2.07 meV, RMSE_F= 29.20 meV / A 2026-03-21 22:17:31.260 INFO: Epoch 1245: head: Default, loss=0.00057821, RMSE_E_per_atom= 2.11 meV, RMSE_F= 33.79 meV / A 2026-03-21 22:23:45.474 INFO: Epoch 1246: head: Default, loss=0.00055970, RMSE_E_per_atom= 2.17 meV, RMSE_F= 33.24 meV / A 2026-03-21 22:29:59.584 INFO: Epoch 1247: head: Default, loss=0.00058662, RMSE_E_per_atom= 2.07 meV, RMSE_F= 34.03 meV / A 2026-03-21 22:36:13.728 INFO: Epoch 1248: head: Default, loss=0.00045068, RMSE_E_per_atom= 2.01 meV, RMSE_F= 29.79 meV / A 2026-03-21 22:42:28.067 INFO: Epoch 1249: head: Default, loss=0.00056621, RMSE_E_per_atom= 2.07 meV, RMSE_F= 33.43 meV / A 2026-03-21 22:48:42.306 INFO: Epoch 1250: head: Default, loss=0.00044869, RMSE_E_per_atom= 2.05 meV, RMSE_F= 29.72 meV / A 2026-03-21 22:54:56.689 INFO: Epoch 1251: head: Default, loss=0.00050515, RMSE_E_per_atom= 2.06 meV, RMSE_F= 31.56 meV / A 2026-03-21 23:01:11.377 INFO: Epoch 1252: head: Default, loss=0.00046332, RMSE_E_per_atom= 2.05 meV, RMSE_F= 30.21 meV / A 2026-03-21 23:07:25.440 INFO: Epoch 1253: head: Default, loss=0.00054405, RMSE_E_per_atom= 2.06 meV, RMSE_F= 32.76 meV / A 2026-03-21 23:13:39.557 INFO: Epoch 1254: head: Default, loss=0.00045671, RMSE_E_per_atom= 2.04 meV, RMSE_F= 29.99 meV / A 2026-03-21 23:19:53.961 INFO: Epoch 1255: head: Default, loss=0.00051452, RMSE_E_per_atom= 2.10 meV, RMSE_F= 31.85 meV / A 2026-03-21 23:26:08.424 INFO: Epoch 1256: head: Default, loss=0.00045774, RMSE_E_per_atom= 2.06 meV, RMSE_F= 30.02 meV / A 2026-03-21 23:32:22.754 INFO: Epoch 1257: head: Default, loss=0.00052707, RMSE_E_per_atom= 2.06 meV, RMSE_F= 32.24 meV / A 2026-03-21 23:38:37.117 INFO: Epoch 1258: head: Default, loss=0.00046828, RMSE_E_per_atom= 2.05 meV, RMSE_F= 30.37 meV / A 2026-03-21 23:44:51.607 INFO: Epoch 1259: head: Default, loss=0.00051761, RMSE_E_per_atom= 2.05 meV, RMSE_F= 31.95 meV / A 2026-03-21 23:51:06.148 INFO: Epoch 1260: head: Default, loss=0.00051542, RMSE_E_per_atom= 2.07 meV, RMSE_F= 31.88 meV / A 2026-03-21 23:57:20.155 INFO: Epoch 1261: head: Default, loss=0.00051593, RMSE_E_per_atom= 2.05 meV, RMSE_F= 31.90 meV / A 2026-03-22 00:03:34.326 INFO: Epoch 1262: head: Default, loss=0.00046932, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.41 meV / A 2026-03-22 00:09:48.730 INFO: Epoch 1263: head: Default, loss=0.00051344, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.82 meV / A 2026-03-22 00:16:03.158 INFO: Epoch 1264: head: Default, loss=0.00047244, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.51 meV / A 2026-03-22 00:22:17.454 INFO: Epoch 1265: head: Default, loss=0.00050090, RMSE_E_per_atom= 2.07 meV, RMSE_F= 31.42 meV / A 2026-03-22 00:28:31.712 INFO: Epoch 1266: head: Default, loss=0.00047333, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.54 meV / A 2026-03-22 00:34:46.140 INFO: Epoch 1267: head: Default, loss=0.00050576, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.58 meV / A 2026-03-22 00:41:00.317 INFO: Epoch 1268: head: Default, loss=0.00049989, RMSE_E_per_atom= 2.11 meV, RMSE_F= 31.39 meV / A 2026-03-22 00:47:14.728 INFO: Epoch 1269: head: Default, loss=0.00050378, RMSE_E_per_atom= 2.07 meV, RMSE_F= 31.52 meV / A 2026-03-22 00:53:29.376 INFO: Epoch 1270: head: Default, loss=0.00047964, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.74 meV / A 2026-03-22 00:59:43.680 INFO: Epoch 1271: head: Default, loss=0.00050042, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.41 meV / A 2026-03-22 01:05:57.852 INFO: Epoch 1272: head: Default, loss=0.00047893, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.72 meV / A 2026-03-22 01:12:12.381 INFO: Epoch 1273: head: Default, loss=0.00049772, RMSE_E_per_atom= 2.06 meV, RMSE_F= 31.32 meV / A 2026-03-22 01:18:26.750 INFO: Epoch 1274: head: Default, loss=0.00048319, RMSE_E_per_atom= 2.06 meV, RMSE_F= 30.86 meV / A 2026-03-22 01:24:40.770 INFO: Epoch 1275: head: Default, loss=0.00049889, RMSE_E_per_atom= 2.07 meV, RMSE_F= 31.36 meV / A 2026-03-22 01:30:55.064 INFO: Epoch 1276: head: Default, loss=0.00049642, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.28 meV / A 2026-03-22 01:37:09.435 INFO: Epoch 1277: head: Default, loss=0.00050048, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.41 meV / A 2026-03-22 01:43:23.493 INFO: Epoch 1278: head: Default, loss=0.00048089, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.78 meV / A 2026-03-22 01:49:37.593 INFO: Epoch 1279: head: Default, loss=0.00049748, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.32 meV / A 2026-03-22 01:55:51.674 INFO: Epoch 1280: head: Default, loss=0.00048495, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.91 meV / A 2026-03-22 02:02:05.715 INFO: Epoch 1281: head: Default, loss=0.00050031, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.41 meV / A 2026-03-22 02:08:20.024 INFO: Epoch 1282: head: Default, loss=0.00048692, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.98 meV / A 2026-03-22 02:14:34.177 INFO: Epoch 1283: head: Default, loss=0.00050024, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.40 meV / A 2026-03-22 02:20:48.860 INFO: Epoch 1284: head: Default, loss=0.00047896, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.72 meV / A 2026-03-22 02:27:03.201 INFO: Epoch 1285: head: Default, loss=0.00049699, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.30 meV / A 2026-03-22 02:33:17.599 INFO: Epoch 1286: head: Default, loss=0.00048119, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.79 meV / A 2026-03-22 02:39:31.883 INFO: Epoch 1287: head: Default, loss=0.00049521, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.24 meV / A 2026-03-22 02:45:46.054 INFO: Epoch 1288: head: Default, loss=0.00048194, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.82 meV / A 2026-03-22 02:52:00.788 INFO: Epoch 1289: head: Default, loss=0.00049511, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.24 meV / A 2026-03-22 02:58:15.290 INFO: Epoch 1290: head: Default, loss=0.00048851, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.03 meV / A 2026-03-22 03:04:29.291 INFO: Epoch 1291: head: Default, loss=0.00049271, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.16 meV / A 2026-03-22 03:10:43.411 INFO: Epoch 1292: head: Default, loss=0.00048536, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.93 meV / A 2026-03-22 03:16:57.520 INFO: Epoch 1293: head: Default, loss=0.00049010, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.08 meV / A 2026-03-22 03:23:11.420 INFO: Epoch 1294: head: Default, loss=0.00048415, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.89 meV / A 2026-03-22 03:29:25.441 INFO: Epoch 1295: head: Default, loss=0.00048764, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.00 meV / A 2026-03-22 03:35:39.587 INFO: Epoch 1296: head: Default, loss=0.00048771, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.00 meV / A 2026-03-22 03:41:53.304 INFO: Epoch 1297: head: Default, loss=0.00048799, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.01 meV / A 2026-03-22 03:48:07.996 INFO: Epoch 1298: head: Default, loss=0.00048649, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.96 meV / A 2026-03-22 03:54:22.483 INFO: Epoch 1299: head: Default, loss=0.00048841, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.03 meV / A 2026-03-22 04:00:36.861 INFO: Epoch 1300: head: Default, loss=0.00048747, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:06:51.068 INFO: Epoch 1301: head: Default, loss=0.00048761, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:13:05.162 INFO: Epoch 1302: head: Default, loss=0.00048768, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:19:18.950 INFO: Epoch 1303: head: Default, loss=0.00048759, RMSE_E_per_atom= 2.03 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:25:33.081 INFO: Epoch 1304: head: Default, loss=0.00048766, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:31:47.112 INFO: Epoch 1305: head: Default, loss=0.00048832, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.02 meV / A 2026-03-22 04:38:01.584 INFO: Epoch 1306: head: Default, loss=0.00048717, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.99 meV / A 2026-03-22 04:44:15.813 INFO: Epoch 1307: head: Default, loss=0.00048758, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.00 meV / A 2026-03-22 04:50:29.985 INFO: Epoch 1308: head: Default, loss=0.00048699, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.98 meV / A 2026-03-22 04:56:44.328 INFO: Epoch 1309: head: Default, loss=0.00048717, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.99 meV / A 2026-03-22 05:02:58.514 INFO: Epoch 1310: head: Default, loss=0.00048799, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.01 meV / A 2026-03-22 05:09:12.376 INFO: Epoch 1311: head: Default, loss=0.00048622, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.96 meV / A 2026-03-22 05:15:26.650 INFO: Epoch 1312: head: Default, loss=0.00048902, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.05 meV / A 2026-03-22 05:21:41.173 INFO: Epoch 1313: head: Default, loss=0.00048824, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.02 meV / A 2026-03-22 05:27:55.298 INFO: Epoch 1314: head: Default, loss=0.00048728, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.99 meV / A 2026-03-22 05:34:09.455 INFO: Epoch 1315: head: Default, loss=0.00048743, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.99 meV / A 2026-03-22 05:40:23.278 INFO: Epoch 1316: head: Default, loss=0.00048639, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.96 meV / A 2026-03-22 05:46:36.914 INFO: Epoch 1317: head: Default, loss=0.00048676, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.97 meV / A 2026-03-22 05:52:50.745 INFO: Epoch 1318: head: Default, loss=0.00048787, RMSE_E_per_atom= 2.04 meV, RMSE_F= 31.01 meV / A 2026-03-22 05:59:05.032 INFO: Epoch 1319: head: Default, loss=0.00048525, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.92 meV / A 2026-03-22 06:05:19.040 INFO: Epoch 1320: head: Default, loss=0.00048695, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.98 meV / A 2026-03-22 06:11:33.383 INFO: Epoch 1321: head: Default, loss=0.00048739, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.99 meV / A 2026-03-22 06:17:47.272 INFO: Epoch 1322: head: Default, loss=0.00048600, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 06:24:01.352 INFO: Epoch 1323: head: Default, loss=0.00048681, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.98 meV / A 2026-03-22 06:30:15.735 INFO: Epoch 1324: head: Default, loss=0.00048710, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.98 meV / A 2026-03-22 06:36:30.046 INFO: Epoch 1325: head: Default, loss=0.00048582, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.94 meV / A 2026-03-22 06:42:44.696 INFO: Epoch 1326: head: Default, loss=0.00048841, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.03 meV / A 2026-03-22 06:48:59.388 INFO: Epoch 1327: head: Default, loss=0.00048706, RMSE_E_per_atom= 2.04 meV, RMSE_F= 30.98 meV / A 2026-03-22 06:55:13.716 INFO: Epoch 1328: head: Default, loss=0.00048719, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.99 meV / A 2026-03-22 07:01:26.986 INFO: Epoch 1329: head: Default, loss=0.00048649, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.96 meV / A 2026-03-22 07:07:40.108 INFO: Epoch 1330: head: Default, loss=0.00048782, RMSE_E_per_atom= 2.00 meV, RMSE_F= 31.01 meV / A 2026-03-22 07:13:53.463 INFO: Epoch 1331: head: Default, loss=0.00048696, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.98 meV / A 2026-03-22 07:20:07.424 INFO: Epoch 1332: head: Default, loss=0.00048750, RMSE_E_per_atom= 2.01 meV, RMSE_F= 31.00 meV / A 2026-03-22 07:26:21.115 INFO: Epoch 1333: head: Default, loss=0.00048602, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 07:32:34.981 INFO: Epoch 1334: head: Default, loss=0.00048672, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.97 meV / A 2026-03-22 07:38:49.096 INFO: Epoch 1335: head: Default, loss=0.00048780, RMSE_E_per_atom= 2.02 meV, RMSE_F= 31.01 meV / A 2026-03-22 07:45:03.026 INFO: Epoch 1336: head: Default, loss=0.00048592, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.95 meV / A 2026-03-22 07:51:16.496 INFO: Epoch 1337: head: Default, loss=0.00048745, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.99 meV / A 2026-03-22 07:57:29.782 INFO: Epoch 1338: head: Default, loss=0.00048613, RMSE_E_per_atom= 2.03 meV, RMSE_F= 30.95 meV / A 2026-03-22 08:03:42.806 INFO: Epoch 1339: head: Default, loss=0.00048728, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.99 meV / A 2026-03-22 08:09:55.970 INFO: Epoch 1340: head: Default, loss=0.00048582, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.94 meV / A 2026-03-22 08:16:09.467 INFO: Epoch 1341: head: Default, loss=0.00048612, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 08:22:23.070 INFO: Epoch 1342: head: Default, loss=0.00048635, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.96 meV / A 2026-03-22 08:28:36.844 INFO: Epoch 1343: head: Default, loss=0.00048603, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.95 meV / A 2026-03-22 08:34:50.669 INFO: Epoch 1344: head: Default, loss=0.00048615, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 08:41:04.586 INFO: Epoch 1345: head: Default, loss=0.00048585, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.94 meV / A 2026-03-22 08:47:18.073 INFO: Epoch 1346: head: Default, loss=0.00048679, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.97 meV / A 2026-03-22 08:53:31.471 INFO: Epoch 1347: head: Default, loss=0.00048625, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.96 meV / A 2026-03-22 08:59:44.594 INFO: Epoch 1348: head: Default, loss=0.00048580, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.94 meV / A 2026-03-22 09:05:58.296 INFO: Epoch 1349: head: Default, loss=0.00048586, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.94 meV / A 2026-03-22 09:12:13.399 INFO: Epoch 1350: head: Default, loss=0.00048611, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 09:18:28.764 INFO: Epoch 1351: head: Default, loss=0.00048599, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.95 meV / A 2026-03-22 09:24:45.254 INFO: Epoch 1352: head: Default, loss=0.00048685, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.98 meV / A 2026-03-22 09:31:01.487 INFO: Epoch 1353: head: Default, loss=0.00048506, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 09:37:17.457 INFO: Epoch 1354: head: Default, loss=0.00048564, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.94 meV / A 2026-03-22 09:43:33.352 INFO: Epoch 1355: head: Default, loss=0.00048621, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.96 meV / A 2026-03-22 09:49:49.316 INFO: Epoch 1356: head: Default, loss=0.00048504, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.92 meV / A 2026-03-22 09:56:04.165 INFO: Epoch 1357: head: Default, loss=0.00048699, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.98 meV / A 2026-03-22 10:02:19.038 INFO: Epoch 1358: head: Default, loss=0.00048506, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.92 meV / A 2026-03-22 10:08:33.535 INFO: Epoch 1359: head: Default, loss=0.00048577, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.94 meV / A 2026-03-22 10:14:49.129 INFO: Epoch 1360: head: Default, loss=0.00048572, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.94 meV / A 2026-03-22 10:21:05.480 INFO: Epoch 1361: head: Default, loss=0.00048555, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.94 meV / A 2026-03-22 10:27:21.753 INFO: Epoch 1362: head: Default, loss=0.00048443, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.90 meV / A 2026-03-22 10:33:36.395 INFO: Epoch 1363: head: Default, loss=0.00048435, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.89 meV / A 2026-03-22 10:39:50.974 INFO: Epoch 1364: head: Default, loss=0.00048486, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 10:46:05.397 INFO: Epoch 1365: head: Default, loss=0.00048506, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.92 meV / A 2026-03-22 10:52:19.815 INFO: Epoch 1366: head: Default, loss=0.00048543, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.93 meV / A 2026-03-22 10:58:34.231 INFO: Epoch 1367: head: Default, loss=0.00048531, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.93 meV / A 2026-03-22 11:04:48.696 INFO: Epoch 1368: head: Default, loss=0.00048567, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.94 meV / A 2026-03-22 11:11:03.080 INFO: Epoch 1369: head: Default, loss=0.00048526, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 11:17:17.457 INFO: Epoch 1370: head: Default, loss=0.00048517, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.92 meV / A 2026-03-22 11:23:31.942 INFO: Epoch 1371: head: Default, loss=0.00048480, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.91 meV / A 2026-03-22 11:29:46.422 INFO: Epoch 1372: head: Default, loss=0.00048581, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.94 meV / A 2026-03-22 11:36:01.016 INFO: Epoch 1373: head: Default, loss=0.00048537, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 11:42:15.700 INFO: Epoch 1374: head: Default, loss=0.00048493, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 11:48:30.290 INFO: Epoch 1375: head: Default, loss=0.00048544, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.93 meV / A 2026-03-22 11:54:45.129 INFO: Epoch 1376: head: Default, loss=0.00048636, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.96 meV / A 2026-03-22 12:00:59.811 INFO: Epoch 1377: head: Default, loss=0.00048434, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 12:07:14.339 INFO: Epoch 1378: head: Default, loss=0.00048575, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.94 meV / A 2026-03-22 12:13:28.789 INFO: Epoch 1379: head: Default, loss=0.00048480, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 12:19:43.460 INFO: Epoch 1380: head: Default, loss=0.00048591, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.95 meV / A 2026-03-22 12:25:57.896 INFO: Epoch 1381: head: Default, loss=0.00048547, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 12:32:12.238 INFO: Epoch 1382: head: Default, loss=0.00048453, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 12:38:25.821 INFO: Epoch 1383: head: Default, loss=0.00048496, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 12:44:39.635 INFO: Epoch 1384: head: Default, loss=0.00048507, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.92 meV / A 2026-03-22 12:50:52.873 INFO: Epoch 1385: head: Default, loss=0.00048539, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.93 meV / A 2026-03-22 12:57:06.389 INFO: Epoch 1386: head: Default, loss=0.00048534, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.93 meV / A 2026-03-22 13:03:19.403 INFO: Epoch 1387: head: Default, loss=0.00048561, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.94 meV / A 2026-03-22 13:09:32.581 INFO: Epoch 1388: head: Default, loss=0.00048478, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 13:15:46.883 INFO: Epoch 1389: head: Default, loss=0.00048532, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.93 meV / A 2026-03-22 13:22:00.771 INFO: Epoch 1390: head: Default, loss=0.00048547, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 13:28:14.862 INFO: Epoch 1391: head: Default, loss=0.00048515, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.92 meV / A 2026-03-22 13:34:28.996 INFO: Epoch 1392: head: Default, loss=0.00048427, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.89 meV / A 2026-03-22 13:40:43.117 INFO: Epoch 1393: head: Default, loss=0.00048488, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 13:46:57.337 INFO: Epoch 1394: head: Default, loss=0.00048531, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.93 meV / A 2026-03-22 13:53:11.628 INFO: Epoch 1395: head: Default, loss=0.00048542, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 13:59:26.726 INFO: Epoch 1396: head: Default, loss=0.00048497, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.92 meV / A 2026-03-22 14:05:41.107 INFO: Epoch 1397: head: Default, loss=0.00048497, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.92 meV / A 2026-03-22 14:11:55.250 INFO: Epoch 1398: head: Default, loss=0.00048459, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 14:18:09.454 INFO: Epoch 1399: head: Default, loss=0.00048528, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.93 meV / A 2026-03-22 14:24:23.988 INFO: Epoch 1400: head: Default, loss=0.00048531, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.93 meV / A 2026-03-22 14:30:38.391 INFO: Epoch 1401: head: Default, loss=0.00048450, RMSE_E_per_atom= 2.02 meV, RMSE_F= 30.90 meV / A 2026-03-22 14:36:52.597 INFO: Epoch 1402: head: Default, loss=0.00048451, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.90 meV / A 2026-03-22 14:43:06.951 INFO: Epoch 1403: head: Default, loss=0.00048433, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 14:49:21.236 INFO: Epoch 1404: head: Default, loss=0.00048458, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 14:55:35.460 INFO: Epoch 1405: head: Default, loss=0.00048470, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.91 meV / A 2026-03-22 15:01:49.704 INFO: Epoch 1406: head: Default, loss=0.00048461, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.91 meV / A 2026-03-22 15:08:03.987 INFO: Epoch 1407: head: Default, loss=0.00048474, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.91 meV / A 2026-03-22 15:14:18.312 INFO: Epoch 1408: head: Default, loss=0.00048450, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.90 meV / A 2026-03-22 15:20:32.856 INFO: Epoch 1409: head: Default, loss=0.00048510, RMSE_E_per_atom= 2.00 meV, RMSE_F= 30.92 meV / A 2026-03-22 15:26:47.153 INFO: Epoch 1410: head: Default, loss=0.00048498, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 15:33:01.446 INFO: Epoch 1411: head: Default, loss=0.00048506, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 15:39:15.542 INFO: Epoch 1412: head: Default, loss=0.00048438, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 15:45:29.793 INFO: Epoch 1413: head: Default, loss=0.00048434, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 15:51:43.668 INFO: Epoch 1414: head: Default, loss=0.00048475, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 15:57:57.544 INFO: Epoch 1415: head: Default, loss=0.00048425, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.89 meV / A 2026-03-22 16:04:46.894 INFO: Epoch 1416: head: Default, loss=0.00048469, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.91 meV / A 2026-03-22 16:12:04.891 INFO: Epoch 1417: head: Default, loss=0.00048405, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.89 meV / A 2026-03-22 16:18:22.401 INFO: Epoch 1418: head: Default, loss=0.00048472, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.91 meV / A 2026-03-22 16:25:11.709 INFO: Epoch 1419: head: Default, loss=0.00048417, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.89 meV / A 2026-03-22 16:32:43.737 INFO: Epoch 1420: head: Default, loss=0.00048456, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 16:40:41.774 INFO: Epoch 1421: head: Default, loss=0.00048471, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.91 meV / A 2026-03-22 16:48:37.820 INFO: Epoch 1422: head: Default, loss=0.00048466, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.91 meV / A 2026-03-22 16:56:15.221 INFO: Epoch 1423: head: Default, loss=0.00048436, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.90 meV / A 2026-03-22 17:03:31.576 INFO: Epoch 1424: head: Default, loss=0.00048457, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.90 meV / A 2026-03-22 17:10:48.615 INFO: Epoch 1425: head: Default, loss=0.00048498, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 17:18:06.679 INFO: Epoch 1426: head: Default, loss=0.00048390, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.88 meV / A 2026-03-22 17:24:25.095 INFO: Epoch 1427: head: Default, loss=0.00048489, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.91 meV / A 2026-03-22 17:30:41.018 INFO: Epoch 1428: head: Default, loss=0.00048420, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.89 meV / A 2026-03-22 17:36:57.026 INFO: Epoch 1429: head: Default, loss=0.00048477, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.91 meV / A 2026-03-22 17:43:13.592 INFO: Epoch 1430: head: Default, loss=0.00048503, RMSE_E_per_atom= 2.01 meV, RMSE_F= 30.92 meV / A 2026-03-22 17:50:46.848 INFO: Epoch 1431: head: Default, loss=0.00048455, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 17:58:46.394 INFO: Epoch 1432: head: Default, loss=0.00048453, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 18:06:42.092 INFO: Epoch 1433: head: Default, loss=0.00048509, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.92 meV / A 2026-03-22 18:14:00.788 INFO: Epoch 1434: head: Default, loss=0.00048426, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.89 meV / A 2026-03-22 18:21:20.041 INFO: Epoch 1435: head: Default, loss=0.00048366, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 18:28:39.534 INFO: Epoch 1436: head: Default, loss=0.00048376, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-22 18:35:58.915 INFO: Epoch 1437: head: Default, loss=0.00048403, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.89 meV / A 2026-03-22 18:43:17.451 INFO: Epoch 1438: head: Default, loss=0.00048450, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.90 meV / A 2026-03-22 18:49:33.282 INFO: Epoch 1439: head: Default, loss=0.00048413, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.89 meV / A 2026-03-22 18:55:49.456 INFO: Epoch 1440: head: Default, loss=0.00048393, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.88 meV / A 2026-03-22 19:02:05.287 INFO: Epoch 1441: head: Default, loss=0.00048425, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.90 meV / A 2026-03-22 19:08:20.911 INFO: Epoch 1442: head: Default, loss=0.00048414, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.89 meV / A 2026-03-22 19:14:36.021 INFO: Epoch 1443: head: Default, loss=0.00048470, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.91 meV / A 2026-03-22 19:20:51.098 INFO: Epoch 1444: head: Default, loss=0.00048446, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.90 meV / A 2026-03-22 19:27:06.176 INFO: Epoch 1445: head: Default, loss=0.00048448, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.90 meV / A 2026-03-22 19:33:22.022 INFO: Epoch 1446: head: Default, loss=0.00048352, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 19:39:38.145 INFO: Epoch 1447: head: Default, loss=0.00048364, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.87 meV / A 2026-03-22 19:45:53.706 INFO: Epoch 1448: head: Default, loss=0.00048391, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 19:52:09.227 INFO: Epoch 1449: head: Default, loss=0.00048353, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 19:58:24.967 INFO: Epoch 1450: head: Default, loss=0.00048387, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:04:40.823 INFO: Epoch 1451: head: Default, loss=0.00048384, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:10:56.457 INFO: Epoch 1452: head: Default, loss=0.00048386, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:17:12.376 INFO: Epoch 1453: head: Default, loss=0.00048434, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.90 meV / A 2026-03-22 20:23:28.786 INFO: Epoch 1454: head: Default, loss=0.00048383, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:29:45.672 INFO: Epoch 1455: head: Default, loss=0.00048379, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:36:03.980 INFO: Epoch 1456: head: Default, loss=0.00048362, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.87 meV / A 2026-03-22 20:42:20.398 INFO: Epoch 1457: head: Default, loss=0.00048438, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.90 meV / A 2026-03-22 20:48:36.845 INFO: Epoch 1458: head: Default, loss=0.00048398, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.88 meV / A 2026-03-22 20:54:53.130 INFO: Epoch 1459: head: Default, loss=0.00048442, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.90 meV / A 2026-03-22 21:01:09.007 INFO: Epoch 1460: head: Default, loss=0.00048405, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.89 meV / A 2026-03-22 21:07:25.294 INFO: Epoch 1461: head: Default, loss=0.00048403, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.89 meV / A 2026-03-22 21:13:41.835 INFO: Epoch 1462: head: Default, loss=0.00048407, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.89 meV / A 2026-03-22 21:19:58.571 INFO: Epoch 1463: head: Default, loss=0.00048438, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.90 meV / A 2026-03-22 21:26:15.097 INFO: Epoch 1464: head: Default, loss=0.00048388, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 21:32:31.785 INFO: Epoch 1465: head: Default, loss=0.00048385, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 21:38:48.563 INFO: Epoch 1466: head: Default, loss=0.00048385, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-22 21:45:05.147 INFO: Epoch 1467: head: Default, loss=0.00048384, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 21:51:21.469 INFO: Epoch 1468: head: Default, loss=0.00048372, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-22 21:57:38.034 INFO: Epoch 1469: head: Default, loss=0.00048352, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 22:03:54.844 INFO: Epoch 1470: head: Default, loss=0.00048390, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.88 meV / A 2026-03-22 22:10:11.026 INFO: Epoch 1471: head: Default, loss=0.00048395, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 22:16:27.313 INFO: Epoch 1472: head: Default, loss=0.00048406, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.89 meV / A 2026-03-22 22:22:43.510 INFO: Epoch 1473: head: Default, loss=0.00048367, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 22:28:59.630 INFO: Epoch 1474: head: Default, loss=0.00048346, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 22:35:16.524 INFO: Epoch 1475: head: Default, loss=0.00048390, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 22:41:33.227 INFO: Epoch 1476: head: Default, loss=0.00048407, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.89 meV / A 2026-03-22 22:47:49.641 INFO: Epoch 1477: head: Default, loss=0.00048416, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.89 meV / A 2026-03-22 22:54:04.696 INFO: Epoch 1478: head: Default, loss=0.00048382, RMSE_E_per_atom= 1.99 meV, RMSE_F= 30.88 meV / A 2026-03-22 23:00:19.251 INFO: Epoch 1479: head: Default, loss=0.00048393, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.88 meV / A 2026-03-22 23:06:33.716 INFO: Epoch 1480: head: Default, loss=0.00048365, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:12:48.239 INFO: Epoch 1481: head: Default, loss=0.00048361, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:19:02.482 INFO: Epoch 1482: head: Default, loss=0.00048336, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.86 meV / A 2026-03-22 23:25:16.828 INFO: Epoch 1483: head: Default, loss=0.00048360, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:31:32.422 INFO: Epoch 1484: head: Default, loss=0.00048358, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:37:48.087 INFO: Epoch 1485: head: Default, loss=0.00048353, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:44:04.182 INFO: Epoch 1486: head: Default, loss=0.00048317, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.86 meV / A 2026-03-22 23:50:20.464 INFO: Epoch 1487: head: Default, loss=0.00048346, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.87 meV / A 2026-03-22 23:56:36.650 INFO: Epoch 1488: head: Default, loss=0.00048348, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:02:52.729 INFO: Epoch 1489: head: Default, loss=0.00048357, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:09:08.174 INFO: Epoch 1490: head: Default, loss=0.00048360, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:15:23.607 INFO: Epoch 1491: head: Default, loss=0.00048392, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.88 meV / A 2026-03-23 00:21:39.157 INFO: Epoch 1492: head: Default, loss=0.00048277, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 00:27:54.527 INFO: Epoch 1493: head: Default, loss=0.00048356, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:34:10.465 INFO: Epoch 1494: head: Default, loss=0.00048353, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:40:26.256 INFO: Epoch 1495: head: Default, loss=0.00048362, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:46:41.786 INFO: Epoch 1496: head: Default, loss=0.00048349, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.87 meV / A 2026-03-23 00:52:57.583 INFO: Epoch 1497: head: Default, loss=0.00048335, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 00:59:13.934 INFO: Epoch 1498: head: Default, loss=0.00048315, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.86 meV / A 2026-03-23 01:05:29.846 INFO: Epoch 1499: head: Default, loss=0.00048338, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 01:11:45.380 INFO: Epoch 1500: head: Default, loss=0.00048305, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 01:18:00.987 INFO: Epoch 1501: head: Default, loss=0.00048303, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 01:24:17.168 INFO: Epoch 1502: head: Default, loss=0.00048338, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.87 meV / A 2026-03-23 01:30:32.793 INFO: Epoch 1503: head: Default, loss=0.00048344, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 01:36:48.057 INFO: Epoch 1504: head: Default, loss=0.00048331, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 01:43:03.560 INFO: Epoch 1505: head: Default, loss=0.00048339, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 01:49:19.551 INFO: Epoch 1506: head: Default, loss=0.00048282, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 01:55:35.702 INFO: Epoch 1507: head: Default, loss=0.00048271, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.84 meV / A 2026-03-23 02:01:51.657 INFO: Epoch 1508: head: Default, loss=0.00048345, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 02:08:07.693 INFO: Epoch 1509: head: Default, loss=0.00048378, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.88 meV / A 2026-03-23 02:14:24.140 INFO: Epoch 1510: head: Default, loss=0.00048368, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 02:20:39.643 INFO: Epoch 1511: head: Default, loss=0.00048344, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 02:26:55.140 INFO: Epoch 1512: head: Default, loss=0.00048317, RMSE_E_per_atom= 1.98 meV, RMSE_F= 30.86 meV / A 2026-03-23 02:33:11.169 INFO: Epoch 1513: head: Default, loss=0.00048301, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.85 meV / A 2026-03-23 02:39:26.576 INFO: Epoch 1514: head: Default, loss=0.00048331, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 02:45:42.560 INFO: Epoch 1515: head: Default, loss=0.00048316, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 02:51:58.638 INFO: Epoch 1516: head: Default, loss=0.00048349, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 02:58:14.484 INFO: Epoch 1517: head: Default, loss=0.00048299, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.85 meV / A 2026-03-23 03:04:30.169 INFO: Epoch 1518: head: Default, loss=0.00048311, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 03:10:46.545 INFO: Epoch 1519: head: Default, loss=0.00048292, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 03:17:01.822 INFO: Epoch 1520: head: Default, loss=0.00048349, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.87 meV / A 2026-03-23 03:23:17.926 INFO: Epoch 1521: head: Default, loss=0.00048354, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.87 meV / A 2026-03-23 03:29:34.272 INFO: Epoch 1522: head: Default, loss=0.00048294, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.85 meV / A 2026-03-23 03:35:50.570 INFO: Epoch 1523: head: Default, loss=0.00048323, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 03:42:06.631 INFO: Epoch 1524: head: Default, loss=0.00048326, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 03:48:22.925 INFO: Epoch 1525: head: Default, loss=0.00048306, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.86 meV / A 2026-03-23 03:54:38.888 INFO: Epoch 1526: head: Default, loss=0.00048315, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 04:00:54.876 INFO: Epoch 1527: head: Default, loss=0.00048299, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 04:07:11.459 INFO: Epoch 1528: head: Default, loss=0.00048304, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 04:13:27.824 INFO: Epoch 1529: head: Default, loss=0.00048338, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.87 meV / A 2026-03-23 04:19:43.933 INFO: Epoch 1530: head: Default, loss=0.00048310, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 04:25:59.642 INFO: Epoch 1531: head: Default, loss=0.00048282, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 04:32:15.957 INFO: Epoch 1532: head: Default, loss=0.00048313, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 04:38:31.994 INFO: Epoch 1533: head: Default, loss=0.00048265, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 04:44:48.568 INFO: Epoch 1534: head: Default, loss=0.00048327, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 04:51:04.655 INFO: Epoch 1535: head: Default, loss=0.00048349, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.87 meV / A 2026-03-23 04:57:20.567 INFO: Epoch 1536: head: Default, loss=0.00048307, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 05:03:36.380 INFO: Epoch 1537: head: Default, loss=0.00048305, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 05:09:52.420 INFO: Epoch 1538: head: Default, loss=0.00048297, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 05:16:08.686 INFO: Epoch 1539: head: Default, loss=0.00048269, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 05:22:24.959 INFO: Epoch 1540: head: Default, loss=0.00048276, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 05:28:41.207 INFO: Epoch 1541: head: Default, loss=0.00048306, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 05:34:57.376 INFO: Epoch 1542: head: Default, loss=0.00048344, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.87 meV / A 2026-03-23 05:41:13.470 INFO: Epoch 1543: head: Default, loss=0.00048272, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.84 meV / A 2026-03-23 05:47:29.759 INFO: Epoch 1544: head: Default, loss=0.00048294, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.85 meV / A 2026-03-23 05:53:45.591 INFO: Epoch 1545: head: Default, loss=0.00048315, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 06:00:01.858 INFO: Epoch 1546: head: Default, loss=0.00048276, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:06:17.780 INFO: Epoch 1547: head: Default, loss=0.00048247, RMSE_E_per_atom= 1.97 meV, RMSE_F= 30.84 meV / A 2026-03-23 06:12:33.554 INFO: Epoch 1548: head: Default, loss=0.00048287, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:18:50.014 INFO: Epoch 1549: head: Default, loss=0.00048290, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:25:06.440 INFO: Epoch 1550: head: Default, loss=0.00048330, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 06:31:22.588 INFO: Epoch 1551: head: Default, loss=0.00048259, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 06:37:38.632 INFO: Epoch 1552: head: Default, loss=0.00048290, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:43:54.492 INFO: Epoch 1553: head: Default, loss=0.00048283, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:50:10.605 INFO: Epoch 1554: head: Default, loss=0.00048286, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 06:56:26.898 INFO: Epoch 1555: head: Default, loss=0.00048295, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 07:02:42.921 INFO: Epoch 1556: head: Default, loss=0.00048296, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.85 meV / A 2026-03-23 07:08:58.727 INFO: Epoch 1557: head: Default, loss=0.00048274, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 07:15:15.003 INFO: Epoch 1558: head: Default, loss=0.00048279, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 07:21:30.808 INFO: Epoch 1559: head: Default, loss=0.00048268, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 07:27:46.802 INFO: Epoch 1560: head: Default, loss=0.00048318, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 07:34:03.011 INFO: Epoch 1561: head: Default, loss=0.00048294, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 07:40:19.342 INFO: Epoch 1562: head: Default, loss=0.00048275, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 07:46:35.343 INFO: Epoch 1563: head: Default, loss=0.00048262, RMSE_E_per_atom= 1.93 meV, RMSE_F= 30.84 meV / A 2026-03-23 07:52:51.585 INFO: Epoch 1564: head: Default, loss=0.00048310, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.86 meV / A 2026-03-23 07:59:07.975 INFO: Epoch 1565: head: Default, loss=0.00048284, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 08:05:24.407 INFO: Epoch 1566: head: Default, loss=0.00048253, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.84 meV / A 2026-03-23 08:11:40.722 INFO: Epoch 1567: head: Default, loss=0.00048299, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 08:17:57.176 INFO: Epoch 1568: head: Default, loss=0.00048297, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.85 meV / A 2026-03-23 08:24:13.246 INFO: Epoch 1569: head: Default, loss=0.00048298, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 08:30:29.225 INFO: Epoch 1570: head: Default, loss=0.00048272, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 08:36:45.564 INFO: Epoch 1571: head: Default, loss=0.00048265, RMSE_E_per_atom= 1.93 meV, RMSE_F= 30.84 meV / A 2026-03-23 08:43:01.558 INFO: Epoch 1572: head: Default, loss=0.00048217, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.83 meV / A 2026-03-23 08:49:17.822 INFO: Epoch 1573: head: Default, loss=0.00048266, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 08:55:34.039 INFO: Epoch 1574: head: Default, loss=0.00048260, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:01:49.777 INFO: Epoch 1575: head: Default, loss=0.00048262, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:08:05.396 INFO: Epoch 1576: head: Default, loss=0.00048307, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 09:14:21.729 INFO: Epoch 1577: head: Default, loss=0.00048264, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:20:37.701 INFO: Epoch 1578: head: Default, loss=0.00048265, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:26:53.974 INFO: Epoch 1579: head: Default, loss=0.00048316, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 09:33:09.861 INFO: Epoch 1580: head: Default, loss=0.00048255, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:39:26.066 INFO: Epoch 1581: head: Default, loss=0.00048239, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.83 meV / A 2026-03-23 09:45:42.068 INFO: Epoch 1582: head: Default, loss=0.00048280, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 09:51:58.157 INFO: Epoch 1583: head: Default, loss=0.00048249, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.84 meV / A 2026-03-23 09:58:14.254 INFO: Epoch 1584: head: Default, loss=0.00048264, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:04:30.176 INFO: Epoch 1585: head: Default, loss=0.00048272, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:10:46.240 INFO: Epoch 1586: head: Default, loss=0.00048323, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.86 meV / A 2026-03-23 10:17:02.521 INFO: Epoch 1587: head: Default, loss=0.00048287, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 10:23:18.562 INFO: Epoch 1588: head: Default, loss=0.00048260, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:29:34.712 INFO: Epoch 1589: head: Default, loss=0.00048274, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 10:35:50.890 INFO: Epoch 1590: head: Default, loss=0.00048266, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:42:07.075 INFO: Epoch 1591: head: Default, loss=0.00048262, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:48:23.434 INFO: Epoch 1592: head: Default, loss=0.00048265, RMSE_E_per_atom= 1.93 meV, RMSE_F= 30.84 meV / A 2026-03-23 10:54:38.086 INFO: Epoch 1593: head: Default, loss=0.00048282, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.85 meV / A 2026-03-23 11:00:52.472 INFO: Epoch 1594: head: Default, loss=0.00048243, RMSE_E_per_atom= 1.95 meV, RMSE_F= 30.83 meV / A 2026-03-23 11:07:06.914 INFO: Epoch 1595: head: Default, loss=0.00048279, RMSE_E_per_atom= 1.93 meV, RMSE_F= 30.85 meV / A 2026-03-23 11:13:20.679 INFO: Epoch 1596: head: Default, loss=0.00048261, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.84 meV / A 2026-03-23 11:19:34.549 INFO: Epoch 1597: head: Default, loss=0.00048242, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.83 meV / A 2026-03-23 11:25:49.205 INFO: Epoch 1598: head: Default, loss=0.00048297, RMSE_E_per_atom= 1.94 meV, RMSE_F= 30.85 meV / A 2026-03-23 11:32:03.428 INFO: Epoch 1599: head: Default, loss=0.00048241, RMSE_E_per_atom= 1.96 meV, RMSE_F= 30.83 meV / A 2026-03-23 11:32:03.429 INFO: Training complete 2026-03-23 11:32:03.429 INFO: 2026-03-23 11:32:03.429 INFO: ===========RESULTS=========== 2026-03-23 11:32:03.771 INFO: Loading checkpoint: ./checkpoints/MACE_run-3_epoch-1192.pt 2026-03-23 11:32:03.812 INFO: Loaded Stage one model from epoch 1192 for evaluation 2026-03-23 11:32:03.812 INFO: Saving model to checkpoints/MACE_run-3.model 2026-03-23 11:32:04.026 INFO: Compiling model, saving metadata to MACE_compiled.model 2026-03-23 11:32:04.817 INFO: Computing metrics for training, validation, and test sets 2026-03-23 11:32:04.818 INFO: Skipping evaluation for heads: ['pt_head'] 2026-03-23 11:32:04.818 INFO: Evaluating train_Default ... 2026-03-23 11:34:26.897 INFO: Evaluating valid_Default ... 2026-03-23 11:34:40.154 INFO: Error-table on TRAIN and VALID: +---------------+---------------------+------------------+-------------------+ | config_type | RMSE E / meV / atom | RMSE F / meV / A | relative F RMSE % | +---------------+---------------------+------------------+-------------------+ | train_Default | 1.8 | 19.5 | 1.69 | | valid_Default | 2.1 | 29.1 | 2.24 | +---------------+---------------------+------------------+-------------------+ 2026-03-23 11:34:40.154 INFO: Evaluating Default_Default ... 2026-03-23 11:34:54.872 INFO: Error-table on TEST: +-----------------+---------------------+------------------+-------------------+ | config_type | RMSE E / meV / atom | RMSE F / meV / A | relative F RMSE % | +-----------------+---------------------+------------------+-------------------+ | Default_Default | 1.6 | 29.2 | 2.98 | +-----------------+---------------------+------------------+-------------------+ 2026-03-23 11:38:28.096 INFO: Done