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Update deepks_force.h
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source/module_hamilt_lcao/module_deepks/deepks_force.h

Lines changed: 3 additions & 3 deletions
Original file line numberDiff line numberDiff line change
@@ -35,9 +35,9 @@ namespace DeePKS_domain
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// for gamma only, pulay and HF terms of force are calculated together
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void cal_f_delta_gamma(
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const std::vector<std::vector<double>>& dm,
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const UnitCell& ucell,
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const LCAO_Orbitals& orb,
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const Grid_Driver& GridD,
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const UnitCell& ucell,
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const LCAO_Orbitals& orb,
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const Grid_Driver& GridD,
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const Parallel_Orbitals& pv,
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const int lmaxd,
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const int nks,

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