Title | ONE-ELECTRON PROPERTIES OF SEVERAL SMALL MOLECULES CALCULATED USING THE LOCAL-DENSITY APPROXIMATION WITHIN DENSITY-FUNCTIONAL THEORY |
Publication Type | Journal Article |
Year of Publication | 1995 |
Authors | Duffy, P, Chong, DP, Dupuis, M |
Journal | Journal of Chemical Physics |
Volume | 102 |
Pagination | 3312-3321 |
Date Published | Feb |
Type of Article | Article |
ISBN Number | 0021-9606 |
Keywords | BASIS-SETS, CORRELATED, DIPOLE MOMENT DERIVATIVES, HARTREE-FOCK LIMIT, HYPERFINE-STRUCTURE, NEON, ORBITALS, POLARIZABILITIES, SPECTROSCOPY, VALENCE, VIBRATIONAL FREQUENCIES, WAVEFUNCTIONS |
URL | <Go to ISI>://A1995QH96700033 |