occ::driver::DMAConfig Struct Reference

#include <dma_driver.h>

Collaboration diagram for occ::driver::DMAConfig:

Public Attributes
std::string	wavefunction_filename
std::string	punch_filename {"dma.punch"}
occ::dma::DMASettings	settings
ankerl::unordered_dense::map< std::string, double >	atom_radii
ankerl::unordered_dense::map< std::string, int >	atom_limits
std::string	axis_method {"none"}
std::vector< int >	axis_atoms
std::string	oriented_xyz_filename
std::string	axis_filename
bool	write_punch {true}
bool	write_oriented_xyz {false}
bool	write_axis_file {false}

Member Data Documentation

atom_limits

ankerl::unordered_dense::map<std::string, int> occ::driver::DMAConfig::atom_limits

atom_radii

ankerl::unordered_dense::map<std::string, double> occ::driver::DMAConfig::atom_radii

axis_atoms

std::vector<int> occ::driver::DMAConfig::axis_atoms

axis_filename

std::string occ::driver::DMAConfig::axis_filename

axis_method

std::string occ::driver::DMAConfig::axis_method {"none"}

oriented_xyz_filename

std::string occ::driver::DMAConfig::oriented_xyz_filename

punch_filename

std::string occ::driver::DMAConfig::punch_filename {"dma.punch"}

settings

occ::dma::DMASettings occ::driver::DMAConfig::settings

wavefunction_filename

std::string occ::driver::DMAConfig::wavefunction_filename

write_axis_file

bool occ::driver::DMAConfig::write_axis_file {false}

write_oriented_xyz

bool occ::driver::DMAConfig::write_oriented_xyz {false}

write_punch

bool occ::driver::DMAConfig::write_punch {true}

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

• /home/runner/work/occ/occ/include/occ/driver/dma_driver.h