3.4.5. `horton/gbasis/calc.h` – Base class for any integral/evaluation of Gaussian functions¶

class

Subclassed by GB1GridFn, GB2DMGridFn, GB2Integral, GB4Integral

Public Functions

GBCalculator::GBCalculator(long max_shell_type)¶

GBCalculator::~GBCalculator()¶

const long GBCalculator::get_nwork() const¶

const long GBCalculator::get_max_shell_type() const¶

const long GBCalculator::get_max_nbasis() const¶

const double *GBCalculator::get_work() const¶

Protected Functions

void GBCalculator::swap_work()¶

Protected Attributes

long GBCalculator::nwork¶

long GBCalculator::max_shell_type¶

long GBCalculator::max_nbasis¶

double *GBCalculator::work_pure¶

double *GBCalculator::work_cart¶