occ
|
#include <cmath>
Namespaces | |
namespace | occ |
namespace | occ::units |
Functions | |
template<typename T > | |
constexpr auto | occ::units::radians (T x) |
template<typename T > | |
constexpr auto | occ::units::degrees (T x) |
template<typename T > | |
constexpr auto | occ::units::angstroms (T x) |
Variables | |
constexpr double | occ::units::BOHR_TO_ANGSTROM = 0.529177210903 |
constexpr double | occ::units::ANGSTROM_TO_BOHR = 1 / BOHR_TO_ANGSTROM |
constexpr double | occ::units::AU_TO_KJ_PER_MOL = 2625.499639 |
constexpr double | occ::units::AU_TO_PER_CM = 219474.63 |
constexpr double | occ::units::AU_TO_KCAL_PER_MOL = 627.5096080305927 |
constexpr double | occ::units::EV_TO_KJ_PER_MOL = 96.48530749925973 |
constexpr double | occ::units::AU_TO_EV = 27.211399 |
constexpr double | occ::units::AU_TO_KELVIN = 315777.09 |
constexpr double | occ::units::KJ_TO_KCAL = AU_TO_KCAL_PER_MOL / AU_TO_KJ_PER_MOL |
constexpr double | occ::units::PI = 3.14159265358979323846 |