cpmdinit_mod Module

Contents

Subroutines

CPMDBASISINIT CPMDSYSTEMINIT GENCPMDSYMREPS EXTRACTSYMLABELS CPMDINIT2INDINT

Subroutines

public subroutine CPMDBASISINIT(nBasisMax, ARR, BRR, G1, LEN)

Arguments

Type	Intent	Optional	Attributes		Name
integer				::	nBasisMax(5,*)
real(kind=dp)				::	ARR(LEN,2)
integer				::	BRR(LEN)
type(BasisFN)				::	G1(LEN)
integer				::	LEN

public subroutine CPMDSYSTEMINIT(LEN)

Arguments

Type	Intent	Optional	Attributes		Name
integer				::	LEN

public subroutine GENCPMDSYMREPS(G1, NBASIS, ARR)

Arguments

Type	Intent	Optional	Attributes		Name
type(BasisFN)				::	G1(*)
integer				::	NBASIS
real(kind=dp)				::	ARR(NBASIS,2)

private subroutine EXTRACTSYMLABELS()

Arguments

None

public subroutine CPMDINIT2INDINT(NHG, NORBUSED, G1, NEL, ECORE, TORDER, ARR, BRR, iCacheFlag)

Arguments

Type	Intent	Optional	Attributes		Name
integer				::	NHG
integer				::	NORBUSED
type(BasisFN)				::	G1(NHG)
integer				::	NEL
real(kind=dp)				::	ECORE
logical				::	TORDER
real(kind=dp)				::	ARR(NSTATES*2,2)
integer				::	BRR(NSTATES*2)
integer				::	iCacheFlag