✦ LIBER ✦

Self consistent field molecular orbital calculation for aniline

✍ Scribed by S. Kwiatkowski; W. Woźnicki

Publisher: Elsevier Science
Year: 1964
Tongue: French
Weight: 145 KB
Volume: 5
Category: Article
ISSN: 0040-4039
DOI: 10.1016/0040-4039(64)83065-3

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Self-consistent field molecular orbital

Self-consistent field molecular orbital calculation for anthranil, benzisoxazole, and benzoxazole

✍ Susan D. Carson; Herbert M. Rosenberg 📂 Article 📅 1969 🏛 Elsevier Science 🌐 English ⚖ 338 KB

Self-consistent-field calculations of mo

Self-consistent-field calculations of molecular magnetic properties using gauge-invariant atomic orbitals

✍ Shinji Kiribayashi; Takao Kobayashi; Masayoshi Nakano; Kizashi Yamaguchi 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 153 KB 👁 1 views

We have developed a program for analytically calculating ## Ž . magnetizabilities for close-shell systems at the self-consistent-field SCF level using Ž . gauge-invariant atomic orbitals GIAOs . The GIAOs integral formulas are derived from our extended Obara᎐Saika recurrence formulas. The GIAO᎐SC

Self-consistent Brueckner theory for mol

Self-consistent Brueckner theory for molecular orbitals

✍ V.A. Kozlov; V.I. Pupyshev 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 407 KB

Molecular orbital self consistent field

Molecular orbital self consistent field studies of methinophosphide and hydrocyanic acid

✍ George F. Adams 📂 Article 📅 1971 🏛 Elsevier Science 🌐 English ⚖ 185 KB

Least distorted localized orbital self-c

Least distorted localized orbital self-consistent field equations

✍ W.H. Adams 📂 Article 📅 1971 🏛 Elsevier Science 🌐 English ⚖ 546 KB

A self consistent field molecular orbita

A self consistent field molecular orbital study of the lithium-formaldehyde system

✍ B.J. McClelland; S. Norton 📂 Article 📅 1983 🏛 Elsevier Science 🌐 English ⚖ 358 KB