Theory of the expansion of wave functions in a gaussian basis
- 5 September 1994
- journal article
- research article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 51 (6) , 447-463
- https://doi.org/10.1002/qua.560510612
Abstract
No abstract availableKeywords
This publication has 13 references indexed in Scilit:
- Gaussian basis sets and the nuclear cusp problemJournal of Molecular Structure: THEOCHEM, 1986
- Rates of convergence and error estimation formulas for the Rayleigh–Ritz variational methodThe Journal of Chemical Physics, 1985
- Rates of convergence of variational calculations and of expectation valuesThe Journal of Chemical Physics, 1984
- Numerical Methods Based on Whittaker Cardinal, or Sinc FunctionsSIAM Review, 1981
- Effective convergence to complete orbital bases and to the atomic Hartree–Fock limit through systematic sequences of Gaussian primitivesThe Journal of Chemical Physics, 1979
- Systematic approach to extended even-tempered orbital bases for atomic and molecular calculationsTheoretical Chemistry Accounts, 1979
- Einführung in die Numerische Mathematik IPublished by Springer Nature ,1972
- Importance of Angular Correlations between Atomic ElectronsPhysical Review B, 1962
- On the eigenfunctions of many‐particle systems in quantum mechanicsCommunications on Pure and Applied Mathematics, 1957
- Electronic wave functions - I. A general method of calculation for the stationary states of any molecular systemProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1950