Recent advances in multireference second order perturbation CI: The CIPSI method revisited
- 1 January 1987
- journal article
- research article
- Published by Wiley in Journal of Computational Chemistry
- Vol. 8 (1) , 39-47
- https://doi.org/10.1002/jcc.540080105
Abstract
No abstract availableKeywords
This publication has 27 references indexed in Scilit:
- Quasi-diabatic states and dynamical couplings from ab initio CI calculations: a new proposalJournal of Physics B: Atomic and Molecular Physics, 1985
- Ab initio study of the photodissociation of nitrosoalkanes and nitrosaminesJournal of the American Chemical Society, 1985
- The use of effective Hamiltonians for the treatment of avoided crossings. I. Adiabatic potential curvesJournal of Physics B: Atomic and Molecular Physics, 1984
- The use of effective Hamiltonians for the treatment of avoided crossings. II. Nearly diabatic potential curvesJournal of Physics B: Atomic and Molecular Physics, 1984
- Theoretical study of the lowest states of CsH and Cs2Journal of Physics B: Atomic and Molecular Physics, 1983
- Theoretical and experimental determination of the lowest excited states of the Kr*2 excimerThe Journal of Chemical Physics, 1983
- The shape-driven graphical unitary group approach to the electron correlation problem. Application to the ethylene moleculeThe Journal of Chemical Physics, 1982
- Evaluation of molecular integrals over Gaussian basis functionsThe Journal of Chemical Physics, 1976
- Computer Programs for Electronic Wave-Function CalculationsReviews of Modern Physics, 1963
- Note on an Approximation Treatment for Many-Electron SystemsPhysical Review B, 1934