ergo
LR::EigenSolver Member List
This is the complete list of members for LR::EigenSolver, including all inherited members.
addToSpace(VarVectorCollection &vecs, E2Evaluator &e2)LR::LRSolver [protected, virtual]
ao2mo(int nbast, const ergo_real *ao, ergo_real *mo) const LR::LRSolver [protected]
buildVector(const ergo_real *w, VarVector &full)LR::LRSolver [protected]
computeExactE2Diag(E2Evaluator &e2)LR::LRSolver
computeMoments(OneElOperator &dipx, OneElOperator &dipy, OneElOperator &dipz)LR::EigenSolver
convThresholdLR::LRSolver
e2diagLR::LRSolver [protected]
EigenSolver(int nbast, int nocc, const ergo_real *fock_matrix, const ergo_real *overlap, int n)LR::EigenSolver [inline]
eSubLR::LRSolver [protected]
getAvMinusFreqSv(ergo_real f, ergo_real *weights, VarVector &r)LR::LRSolver [protected]
getFreq(int i) const LR::EigenSolver [inline]
getInitialGuess(VarVectorCollection &vecs)LR::EigenSolver [virtual]
getPreconditionerShift(int i) const LR::EigenSolver [inline, virtual]
getResidual(VarVectorCollection &residualv)LR::EigenSolver [virtual]
getTransitionMoment2(int i) const LR::EigenSolver [inline]
increaseSubspaceLimit(int newSize)LR::EigenSolver [virtual]
last_evLR::EigenSolver [private]
LRSolver(int nbast, int nocc, const ergo_real *fock_matrix, const ergo_real *s)LR::LRSolver
maxSubspaceSizeLR::LRSolver
mo2ao(int nbast, const ergo_real *mo, ergo_real *ao) const LR::LRSolver [protected]
MVECLR::LRSolver [protected, static]
nbastLR::LRSolver [protected]
nConvergedLR::EigenSolver [private]
noccLR::LRSolver [protected]
nStatesLR::EigenSolver [private]
operToVec(OneElOperator &oper, VarVector &res) const LR::LRSolver [protected]
projectOnSubspace(const VarVector &full, ergo_real *w)LR::LRSolver [protected]
ritzValsLR::EigenSolver [private]
setE2diag(int nbast, int nocc, const ergo_real *fock_matrix, const ergo_real *s)LR::LRSolver [protected]
solve(E2Evaluator &e, bool diskMode=false)LR::LRSolver
sSubLR::LRSolver [protected]
subspaceSizeLR::LRSolver [protected]
transMoms2LR::EigenSolver [private]
vectsLR::LRSolver [protected]
xSubLR::LRSolver [protected]
~EigenSolver()LR::EigenSolver [inline, virtual]
~LRSolver()LR::LRSolver [inline, virtual]