feature_type gtinv
cutoff 6.0
gaussian_params1 1.0 1.0 1
gaussian_params2 0.0 5.0 13
reg_alpha_params -4 3 15

model_type 4
max_p 2
gtinv_order 4
gtinv_maxl 12 8 2

include_force True
include_stress True

n_type 1
elements Mo
atomic_energy -4.58763796

test_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/test_vasprun_high/*.polymlp True 1.0
test_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/test_vasprun_high_woforce1/*.polymlp False 1.0
test_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/test_vasprun_high_woforce2/*.polymlp False 0.1
test_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/test_vasprun_low/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_0/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_1/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_2/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_3/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_4/*.polymlp True 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_high_woforce1/*.polymlp False 1.0
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_high_woforce2/*.polymlp False 0.1
train_data /home/seko/mlip/1-unary/Mo/dataset-2024/3-dft/train_vasprun_large_d/*.polymlp True 1.0