occ::xtb::AnisotropicPairGradient Struct Reference

#include <anisotropic.h>

Public Attributes
Mat3N	grad_explicit
Vec	dE_dcn

Member Data Documentation

dE_dcn

Vec occ::xtb::AnisotropicPairGradient::dE_dcn

grad_explicit

Mat3N occ::xtb::AnisotropicPairGradient::grad_explicit

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The documentation for this struct was generated from the following file:

• /home/runner/work/occ/occ/include/occ/xtb/anisotropic.h