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ergo
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This is the complete list of members for XCEvaluatorUnrestricted, including all inherited members.
| aoMap | XCEvaluator | protected |
| bisOrig | XCEvaluator | protected |
| bisPermuted | XCEvaluator | protected |
| dMat | XCEvaluatorUnrestricted | private |
| getXC(int nElectrons, symmMatrix &xcA, symmMatrix &xcB, real *xcEnergy, int nThreads) const | XCEvaluatorUnrestricted | |
| gss | XCEvaluator | protected |
| integralInfo | XCEvaluator | protected |
| mol | XCEvaluator | protected |
| pattern | XCEvaluator | protected |
| permutationHML | XCEvaluator | protected |
| XCEvaluator(const BasisInfoStruct &bisOrig_, const IntegralInfo &integralInfo_, const Molecule &mol_, const Dft::GridParams &gss_, std::vector< int > const &permutationHML_, const symmMatrix &dens) | XCEvaluator | |
| XCEvaluatorUnrestricted(const BasisInfoStruct &bisOrig_, const IntegralInfo &integralInfo_, const Molecule &mol_, const Dft::GridParams &gss_, std::vector< int > const &permutationHML_, const symmMatrix &densA, const symmMatrix &densB) | XCEvaluatorUnrestricted | inline |
| ~XCEvaluator() | XCEvaluator | |
| ~XCEvaluatorUnrestricted() | XCEvaluatorUnrestricted | inline |