occ::io::PairInput Struct Reference

#include <occ_input.h>

Public Attributes
std::string	source_a {"none"}
Mat3	rotation_a {Mat3::Identity()}
Vec3	translation_a {Vec3::Zero()}
int	ecp_electrons_a {0}
std::string	source_b {"none"}
Mat3	rotation_b {Mat3::Identity()}
Vec3	translation_b {Vec3::Zero()}
int	ecp_electrons_b {0}
std::string	model_name {"ce-b3lyp"}

Member Data Documentation

ecp_electrons_a

int occ::io::PairInput::ecp_electrons_a {0}

ecp_electrons_b

int occ::io::PairInput::ecp_electrons_b {0}

model_name

std::string occ::io::PairInput::model_name {"ce-b3lyp"}

rotation_a

Mat3 occ::io::PairInput::rotation_a {Mat3::Identity()}

rotation_b

Mat3 occ::io::PairInput::rotation_b {Mat3::Identity()}

source_a

std::string occ::io::PairInput::source_a {"none"}

source_b

std::string occ::io::PairInput::source_b {"none"}

translation_a

Vec3 occ::io::PairInput::translation_a {Vec3::Zero()}

translation_b

Vec3 occ::io::PairInput::translation_b {Vec3::Zero()}

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

• /home/runner/work/occ/occ/include/occ/io/occ_input.h