|
real(kind=dp),
|
public, |
allocatable
|
:: |
CoeffT1(:,:) |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
CoeffT1Tag |
|
|
|
|
integer,
|
public |
|
:: |
MemAllocRot |
|
|
|
|
integer,
|
public |
|
:: |
NoSymLabelCounts |
|
|
|
|
integer,
|
public, |
allocatable
|
:: |
SymLabelList2_rot(:) |
|
|
|
|
integer,
|
public, |
allocatable
|
:: |
SymLabelCounts2_rot(:,:) |
|
|
|
|
integer,
|
public, |
allocatable
|
:: |
SymLabelListInv_rot(:) |
|
|
|
|
integer,
|
public, |
allocatable
|
:: |
SymLabelList3_rot(:) |
|
|
|
|
integer,
|
public, |
allocatable
|
:: |
SymOrbs_rot(:) |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
SymLabelList2_rotTag |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
SymLabelCounts2_rotTag |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
SymLabelListInv_rotTag |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
SymLabelList3_rotTag |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
SymOrbs_rotTag |
|
|
|
|
integer(kind=TagIntType),
|
public |
|
:: |
EvaluesTruncTag |
|
|
|
|
real(kind=dp),
|
public, |
allocatable
|
:: |
EvaluesTrunc(:) |
|
|
|
|
integer,
|
public |
|
:: |
NoOrbs |
|
|
|
|
integer,
|
public |
|
:: |
SpatOrbs |
|
|
|
|
integer,
|
public |
|
:: |
NoFrozenVirt |
|
|
|
|
integer,
|
public |
|
:: |
NoRotOrbs |
|
|
|
|
real(kind=dp),
|
public |
|
:: |
TruncEval |
|
|
|
|
integer,
|
public |
|
:: |
transform_unit |
|
|
|
|
type(timer),
|
public |
|
:: |
FillOneRDM_Time |
|
|
|
|
type(timer),
|
public |
|
:: |
FillMP2VDM_Time |
|
|
|
|
type(timer),
|
public |
|
:: |
DiagNatOrbMat_Time |
|
|
|
|
type(timer),
|
public |
|
:: |
OrderCoeff_Time |
|
|
|
|
type(timer),
|
public |
|
:: |
FillCoeff_Time |
|
|
|
|
logical,
|
public |
|
:: |
tTurnStoreSpinOff |
|
|
|