A phase-fitting and first derivative phase-fitting singularly P-stable economical two-step method for problems in quantum chemistry
Maxim A. Medvedev, Theodore E. Simos
Topics & Concepts
Mathematical chemistryDerivative (finance)Order (exchange)Algebraic numberMathematicsFunction (biology)Phase (matter)QuantumQuantum chemistryApplied mathematicsSecond derivativeScheme (mathematics)ChemistryMathematical analysisQuantum mechanicsCombinatoricsPhysicsReaction mechanismOrganic chemistryEconomicsFinancial economicsEvolutionary biologyFinanceBiologyCatalysisNumerical methods for differential equationsMatrix Theory and AlgorithmsAdvanced Optimization Algorithms Research