crystalgeometry::unitcell Type Reference

Inheritance diagram for crystalgeometry::unitcell:

Public Member Functions
procedure, pass	setunitcellparameters
procedure, pass	setunitcellvolume
procedure, pass	setunitcellmetric
procedure, pass	setunitcellvectors
procedure, pass	setunitcellcovectors
procedure, pass	crystaltophysical
procedure, pass	reciprocaltophysical
procedure, pass	physicaltocrystal
procedure, pass	physicaltoreciprocal

Public Attributes
real	a
real	b
real	c
real	alf
real	bet
real	gam
real, dimension(:,:), allocatable	metric
real, dimension(:,:), allocatable	inversemetric
type(vector), dimension(:), allocatable	vectors
type(vector), dimension(:), allocatable	covectors
real, allocatable	volume

Member Function/Subroutine Documentation

crystaltophysical()

procedure, pass crystalgeometry::unitcell::crystaltophysical

physicaltocrystal()

procedure, pass crystalgeometry::unitcell::physicaltocrystal

physicaltoreciprocal()

procedure, pass crystalgeometry::unitcell::physicaltoreciprocal

reciprocaltophysical()

procedure, pass crystalgeometry::unitcell::reciprocaltophysical

setunitcellcovectors()

procedure, pass crystalgeometry::unitcell::setunitcellcovectors

setunitcellmetric()

procedure, pass crystalgeometry::unitcell::setunitcellmetric

setunitcellparameters()

procedure, pass crystalgeometry::unitcell::setunitcellparameters

setunitcellvectors()

procedure, pass crystalgeometry::unitcell::setunitcellvectors

setunitcellvolume()

procedure, pass crystalgeometry::unitcell::setunitcellvolume

Member Data Documentation

a

real crystalgeometry::unitcell::a

alf

real crystalgeometry::unitcell::alf

b

real crystalgeometry::unitcell::b

bet

real crystalgeometry::unitcell::bet

c

real crystalgeometry::unitcell::c

covectors

type(vector), dimension(:), allocatable crystalgeometry::unitcell::covectors

gam

real crystalgeometry::unitcell::gam

inversemetric

real, dimension(:,:), allocatable crystalgeometry::unitcell::inversemetric

metric

real, dimension(:,:), allocatable crystalgeometry::unitcell::metric

vectors

type(vector), dimension(:), allocatable crystalgeometry::unitcell::vectors

volume

real, allocatable crystalgeometry::unitcell::volume

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

• CrystalGeometry.f90