| 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 | |
| convThreshold | LR::LRSolver | |
| e2diag | LR::LRSolver | [protected] |
| EigenSolver(int nbast, int nocc, const ergo_real *fock_matrix, const ergo_real *overlap, int n) | LR::EigenSolver | [inline] |
| eSub | LR::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_ev | LR::EigenSolver | [private] |
| LRSolver(int nbast, int nocc, const ergo_real *fock_matrix, const ergo_real *s) | LR::LRSolver | |
| maxSubspaceSize | LR::LRSolver | |
| mo2ao(int nbast, const ergo_real *mo, ergo_real *ao) const | LR::LRSolver | [protected] |
| MVEC | LR::LRSolver | [protected, static] |
| nbast | LR::LRSolver | [protected] |
| nConverged | LR::EigenSolver | [private] |
| nocc | LR::LRSolver | [protected] |
| nStates | LR::EigenSolver | [private] |
| operToVec(OneElOperator &oper, VarVector &res) const | LR::LRSolver | [protected] |
| projectOnSubspace(const VarVector &full, ergo_real *w) | LR::LRSolver | [protected] |
| ritzVals | LR::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 | |
| sSub | LR::LRSolver | [protected] |
| subspaceSize | LR::LRSolver | [protected] |
| transMoms2 | LR::EigenSolver | [private] |
| vects | LR::LRSolver | [protected] |
| xSub | LR::LRSolver | [protected] |
| ~EigenSolver() | LR::EigenSolver | [inline, virtual] |
| ~LRSolver() | LR::LRSolver | [inline, virtual] |
