IGMPlot
3.16
Optimized IGMplot version able to use wfn/wfx/xyz files
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Here is a list of all documented struct and union fields with links to the struct/union documentation for each field:
- s -
score() :
NCISolver
scoreInterac :
Results
setBAF() :
ProgData
setChemFormula() :
NCISolver
setCOREMOandELEC() :
NCISolver
setCube() :
ProgData
setDensityMatrixForPauli() :
NCISolver
setGradNull() :
LocalData
setIBSI() :
ProgData
setIBSIPrimList() :
NCISolver
setNbAtomMolA() :
ProgData
setNbAtomMolB() :
ProgData
setNbSteps() :
ProgData
setPrimList() :
NCISolver
setRadius() :
ProgData
setscoreInterac() :
Results
setsumdgInter() :
Results
shouldCompute :
Node
solve() :
NCISolver
sortLambdas() :
Node
squareMultInvR :
Node
squareX :
Node
squareY :
Node
squareZ :
Node
stop :
NCISolver
storeBondLength() :
ProgData
storeBondVector() :
ProgData
sum() :
Results
sumBRho :
Node
sumDeltaGInterAtom :
Results
sumdgInter :
Results
sumSquareBRho :
Node
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1.13.2