BASIS SET LIMIT GEOMETRIES FOR AMMONIA AT THE SCF AND MP2 LEVELS OF THEORY

[1] BINKLEY JS, GAUSSIAN 82

[2] STRUCTURE OF VINYL ALCOHOL [J]. JOURNAL OF MOLECULAR STRUCTURE, 1978, 43 (02) : 267 - 271

[3] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .17. GEOMETRIES AND BINDING-ENERGIES OF 2ND-ROW MOLECULES - COMPARISON OF 3 BASIS SETS [J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (12) : 5142 - 5151

[4] THE ROTATIONAL SPECTRA OF HCNH+ AND COH+ FROM QUANTUM-MECHANICAL CALCULATIONS [J]. ASTROPHYSICAL JOURNAL, 1982, 257 (01) : 376 - 382

[5] EFFECT OF ELECTRON CORRELATION ON THEORETICAL EQUILIBRIUM GEOMETRIES .2. COMPARISON OF THIRD-ORDER PERTURBATION AND CONFIGURATION-INTERACTION RESULTS WITH EXPERIMENT [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (21) : 5576 - 5580

[6] THE ROTATIONAL SPECTRA OF HOCO+, HOCN, HN3, AND HNCO FROM QUANTUM-MECHANICAL CALCULATIONS [J]. ASTROPHYSICAL JOURNAL, 1982, 254 (01) : 405 - 411

[7] THE QUANTUM-MECHANICAL CALCULATION OF ROTATIONAL SPECTRA - A COMPARISON OF METHODS FOR C2H2, HCN, HNC, HCO+, N2H+, CO, AND N2 - PREDICTIONS FOR HCNH+, COH+, HBO, HBNH, AND HBF+ [J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (08) : 3720 - 3725

[8] DEFREES DJ, 1983, J AM CHEM SOC, V105, P3745, DOI 10.1021/ja00349a602

[9] A RAPIDLY CONVERGENT DESCENT METHOD FOR MINIMIZATION [J]. COMPUTER JOURNAL, 1963, 6 (02) : 163 - &

[10] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .25. SUPPLEMENTARY FUNCTIONS FOR GAUSSIAN-BASIS SETS [J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (07) : 3265 - 3269

[1] BINKLEY JS, GAUSSIAN 82

[2] STRUCTURE OF VINYL ALCOHOL [J]. JOURNAL OF MOLECULAR STRUCTURE, 1978, 43 (02) : 267 - 271

[3] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .17. GEOMETRIES AND BINDING-ENERGIES OF 2ND-ROW MOLECULES - COMPARISON OF 3 BASIS SETS [J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (12) : 5142 - 5151

[4] THE ROTATIONAL SPECTRA OF HCNH+ AND COH+ FROM QUANTUM-MECHANICAL CALCULATIONS [J]. ASTROPHYSICAL JOURNAL, 1982, 257 (01) : 376 - 382

[5] EFFECT OF ELECTRON CORRELATION ON THEORETICAL EQUILIBRIUM GEOMETRIES .2. COMPARISON OF THIRD-ORDER PERTURBATION AND CONFIGURATION-INTERACTION RESULTS WITH EXPERIMENT [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (21) : 5576 - 5580

[6] THE ROTATIONAL SPECTRA OF HOCO+, HOCN, HN3, AND HNCO FROM QUANTUM-MECHANICAL CALCULATIONS [J]. ASTROPHYSICAL JOURNAL, 1982, 254 (01) : 405 - 411

[7] THE QUANTUM-MECHANICAL CALCULATION OF ROTATIONAL SPECTRA - A COMPARISON OF METHODS FOR C2H2, HCN, HNC, HCO+, N2H+, CO, AND N2 - PREDICTIONS FOR HCNH+, COH+, HBO, HBNH, AND HBF+ [J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (08) : 3720 - 3725

[8] DEFREES DJ, 1983, J AM CHEM SOC, V105, P3745, DOI 10.1021/ja00349a602

[9] A RAPIDLY CONVERGENT DESCENT METHOD FOR MINIMIZATION [J]. COMPUTER JOURNAL, 1963, 6 (02) : 163 - &

[10] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .25. SUPPLEMENTARY FUNCTIONS FOR GAUSSIAN-BASIS SETS [J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (07) : 3265 - 3269