mpqc::constants::mpqc2< Real > Struct Template Reference

Documentation

template<typename Real>
struct mpqc::constants::mpqc2< Real >

The constants system used by MPQC2

Note

based on CODATA1986, except the atomic mass unit see http://physics.nist.gov/cuu/pdf/codata86.pdf

Public Types
using	real_t = Real

Static Public Attributes
static constexpr const char *const	description
static constexpr real_t	bohr_radius = 5.29177249e-11
static constexpr real_t	elementary_charge = 1.60217733e-19
static constexpr real_t	electron_mass = 9.1093897e-31
static constexpr real_t	Avogadro_constant = 6.0221367e23
static constexpr real_t	Planck_constant = 6.6260755e-34
static constexpr real_t	atomic_mass_unit = 1.6605655e-27
static constexpr real_t	Hartree_to_electron_volt = 27.2113834

Member Typedef Documentation

real_t

template<typename Real >

using mpqc::constants::mpqc2< Real >::real_t = Real

Member Data Documentation

atomic_mass_unit

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::atomic_mass_unit = 1.6605655e-27

staticconstexpr

Avogadro_constant

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::Avogadro_constant = 6.0221367e23

staticconstexpr

bohr_radius

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::bohr_radius = 5.29177249e-11

staticconstexpr

description

template<typename Real >

constexpr const char* const mpqc::constants::mpqc2< Real >::description

staticconstexpr

Initial value:

=
      "MPQC 2.3 constants, based on 1986 CODATA"

electron_mass

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::electron_mass = 9.1093897e-31

staticconstexpr

elementary_charge

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::elementary_charge = 1.60217733e-19

staticconstexpr

Hartree_to_electron_volt

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::Hartree_to_electron_volt = 27.2113834

staticconstexpr

Planck_constant

template<typename Real >

constexpr real_t mpqc::constants::mpqc2< Real >::Planck_constant = 6.6260755e-34

staticconstexpr

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

• mpqc/chemistry/units/units.h