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- [1] THE COUPLED PAIR FUNCTIONAL (CPF) - A SIZE CONSISTENT MODIFICATION OF THE CI(SD) BASED ON AN ENERGY FUNCTIONAL[J]. JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (02) : 890 - 898AHLRICHS, RSCHARF, PEHRHARDT, C
- [2] THE CHOICE OF GAUSSIAN-BASIS SETS FOR MOLECULAR ELECTRONIC-STRUCTURE CALCULATIONS[J]. JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1981, 78 (04) : 315 - 324AHLRICHS, RTAYLOR, PR
- [3] GENERAL CONTRACTION OF GAUSSIAN-BASIS SETS .1. ATOMIC NATURAL ORBITALS FOR 1ST-ROW AND 2ND-ROW ATOMS[J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (07) : 4070 - 4077ALMLOF, JTAYLOR, PR
- [4] FULL CL BENCHMARK CALCULATIONS ON N-2, NO, AND O-2 - A COMPARISON OF METHODS FOR DESCRIBING MULTIPLE BONDS[J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (10) : 5595 - 5599BAUSCHLICHER, CWLANGHOFF, SR
- [5] THEORETICAL-STUDY OF THE NITROGEN ATOM HYPERFINE COUPLING-CONSTANT[J]. JOURNAL OF CHEMICAL PHYSICS, 1988, 89 (05) : 2985 - 2992BAUSCHLICHER, CWLANGHOFF, SRPARTRIDGE, HCHONG, DP
- [6] ON THE ELECTRON-AFFINITY OF THE OXYGEN ATOM[J]. JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (06) : 3407 - 3410BAUSCHLICHER, CWLANGHOFF, SRPARTRIDGE, HTAYLOR, PR
- [7] THEORETICAL-STUDIES OF THE POTENTIAL SURFACE FOR THE F+H-2-]HF+H REACTION[J]. JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (03) : 1743 - 1751BAUSCHLICHER, CWWALCH, SPLANGHOFF, SRTAYLOR, PRJAFFE, RL
- [8] ACCURATE ABINITIO CALCULATIONS WHICH DEMONSTRATE A 3IIU GROUND-STATE FOR AL2[J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 86 (12) : 7007 - 7012BAUSCHLICHER, CWPARTRIDGE, HLANGHOFF, SRTAYLOR, PRWALCH, SP
- [9] SINGLET AND TRIPLET ENERGY SURFACES OF NIH2[J]. JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (09) : 5682 - 5692BLOMBERG, MRASIEGBAHN, PEM
- [10] THEORETICAL CHARACTERIZATION OF NEGATIVE-IONS - CALCULATION OF THE ELECTRON-AFFINITIES OF CARBON, OXYGEN, AND FLUORINE[J]. JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (12) : 6046 - 6056BOTCH, BHDUNNING, TH