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Sojung Koo
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ci: update MatGL imports in LAMMPS workflow
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Lines changed: 6 additions & 6 deletions

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‎.github/workflows/lammps-build.yml‎

Lines changed: 6 additions & 6 deletions
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@@ -169,9 +169,9 @@ jobs:
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import torch
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from pymatgen.core import Lattice, Structure
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from pymatgen.optimization.neighbors import find_points_in_spheres
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from matgl.apps._pes_pyg import Potential
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from matgl.ext._lammps import LAMMPSMatGLModel
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from matgl.models._tensornet_pyg import TensorNet
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from matgl.apps.pes import Potential
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from matgl.ext.lammps import LAMMPSMatGLModel
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from matgl.models._tensornet import TensorNet
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torch.manual_seed(0)
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m = TensorNet(
@@ -443,9 +443,9 @@ jobs:
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import torch
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from pymatgen.core import Lattice, Structure
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from pymatgen.optimization.neighbors import find_points_in_spheres
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from matgl.apps._pes_pyg import Potential
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from matgl.ext._lammps import LAMMPSMatGLModel
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from matgl.models._tensornet_pyg import TensorNet
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from matgl.apps.pes import Potential
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from matgl.ext.lammps import LAMMPSMatGLModel
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from matgl.models._tensornet import TensorNet
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torch.manual_seed(0)
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m = TensorNet(

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