occ::xtb::CoordinationNumbersWithGradient Struct Reference

#include <coordination.h>

Public Attributes
Vec	cn
std::vector< Mat3N >	dcn

Member Data Documentation

cn

Vec occ::xtb::CoordinationNumbersWithGradient::cn

dcn

std::vector<Mat3N> occ::xtb::CoordinationNumbersWithGradient::dcn

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

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