unit_conversion.h File Reference

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Namespaces
	qmcplusplus
	helper functions for EinsplineSetBuilder
	qmcplusplus::Units
	qmcplusplus::Units::constants
	qmcplusplus::Units::count
	qmcplusplus::Units::distance
	qmcplusplus::Units::time
	qmcplusplus::Units::mass
	qmcplusplus::Units::energy
	qmcplusplus::Units::charge
	qmcplusplus::Units::pressure
	qmcplusplus::Units::force

Typedefs
using	real = QMCTraits::RealType

Enumerations
enum	units {   mol = 0, A, B, m,   nm, pm, fm, s,   ms, ns, ps, fs,   kg, me, mp, amu,   Da, J, eV, Ry,   Ha, kJ_mol, K, C,   e, Pa, bar, Mbar,   GPa, atm, N, pN,   mole, angstrom, bohr, meter,   nanometer, picometer, femtometer, second,   millisecond, nanosecond, picosecond, femtosecond,   kilogram, electron_mass, proton_mass, atomic_mass_unit,   dalton, joule, electron_volt, rydberg,   hartree, kilojoule_per_mole, kelvin, coulomb,   proton_charge, pascal, megabar, gigapascal,   atmosphere, newton, piconewton, nunits }

Functions
real	convert (real value, units units_in, units units_out)
template<typename array >
void	convert_array (array &values, units units_in, units units_out)
units	count_unit (const std::string &su)
	convert from std::string to count unit More...
units	distance_unit (const std::string &su)
	convert from std::string to distance unit More...
units	time_unit (const std::string &su)
	convert from std::string to time unit More...
units	mass_unit (const std::string &su)
	convert from std::string to mass unit More...
units	energy_unit (const std::string &su)
	convert from std::string to energy unit More...
units	charge_unit (const std::string &su)
	convert from std::string to charge unit More...
units	pressure_unit (const std::string &su)
	convert from std::string to pressure unit More...
units	force_unit (const std::string &su)
	convert from std::string to force unit More...

Variables
const real	kb = 1.3806503e-23
const real	mol = 6.0221415e23
const real	m = 1.e0
const real	A = 1.e-10 * m
const real	B = .52917720859e-10 * m
const real	nm = 1.e-9 * m
const real	pm = 1.e-12 * m
const real	fm = 1.e-15 * m
const real	s = 1.e0
const real	ms = 1.e-3 * s
const real	ns = 1.e-9 * s
const real	ps = 1.e-12 * s
const real	fs = 1.e-15 * s
const real	kg = 1.e0
const real	me = 9.10938291e-31 * kg
const real	mp = 1.672621777e-27 * kg
const real	amu = 1.660538921e-27 * kg
const real	Da = amu
const real	J = 1.e0
const real	eV = 1.60217646e-19 * J
const real	Ry = 13.6056923 * eV
const real	Ha = 2 * Ry
const real	kJ_mol = 1000. * J / mol
const real	K = J / kb
const real	C = 1.e0
const real	e = 1.60217646e-19 * C
const real	Pa = 1.e0
const real	bar = 1.e5 * Pa
const real	Mbar = 1.e6 * bar
const real	GPa = 1.e9 * Pa
const real	atm = 1.01325e5 * Pa
const real	N = 1.e0
const real	pN = 1e-12 * N
const real	unit_values [nunits]