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Merged
knc6 merged 1 commit into from
Apr 3, 2026
Merged

Dev #3

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2 changes: 1 addition & 1 deletion slakonet/main.py
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Original file line number Diff line number Diff line change
Expand Up @@ -3244,4 +3244,4 @@ def print_energy(a=atoms):
fig_bands, ax_bands = calc_bands.plot_band_structure(
fermi_shift=True, save_path="bands_enhanced.png"
)
plt.show()
plt.show()
2 changes: 1 addition & 1 deletion slakonet/optim.py
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Expand Up @@ -3325,4 +3325,4 @@ def get_hamiltonian(jarvis_atoms=None, kpts=[1, 4, 4], model=None):
# )
multi_vasp_training()

# """
# """
2 changes: 1 addition & 1 deletion slakonet/train_slakonet.py
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Expand Up @@ -106,4 +106,4 @@ class SlakoNetConfig(BaseSettings):
bandgap_weight=config.bandgap_weight,
)

print("\n✅ Training completed successfully!")
print("\n✅ Training completed successfully!")
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