✦ LIBER ✦

Hyperfine structure of 13C in the sp3 (5S) state

✍ Scribed by U. Kaldor

Publisher: Elsevier Science
Year: 1972
Tongue: English
Weight: 488 KB
Volume: 14
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(72)87160-4

No coin nor oath required. For personal study only.

✦ Synopsis

The spin-optimized s?lf-consistent-Be!d (SO SCF) method is applied to the sp3 (5S) state of the carbon atcm, with sirnulta~ous optimization of spatial orbit& and the spin function. The calculated spin density at the nucleus is 2.91 au, yl?klding a hfs constant of 818 hlH7. for *k. The insig-&?cance of 1 s polarkfion is beiicvcd to result from mutual cancellation of the effects of unpaired 2s and 2p electrons 13C hfs calculations in organic radicals are commented upon in the Ii&t of atomic resulrs.

📜 SIMILAR VOLUMES

Hyperfine structure investigations in th

Hyperfine structure investigations in the excited B 3Π0 + state of IF

✍ H.D. Hartmann; H. Knöckel; E. Tiemann 📂 Article 📅 1985 🏛 Elsevier Science 🌐 English ⚖ 454 KB

IF molecules were prepa.red in a miaowave disckuge by using C3FpI Cheptafluoro-2-iodopropane) or by the direct reaction X2 + F2 \_ The hyperfine structure of the rotational transitions f + 1 -f = 54 of the nirational level u' = 3 and 6 -5 of U' = 4 in the excited electronic state B 3 n e+ of IF has

Hyperfine structure of the Na2 13Δg stat

Hyperfine structure of the Na2 13Δg state

✍ Li Li; Qingshi Zhu; Robert W. Field 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 911 KB

Radical ions of dithieno[3,4b; 3′, 4′-e]

Radical ions of dithieno[3,4b; 3′, 4′-e]paradithiin1,3,5,7-tetraone. Hyperfine structure from 13C, 17O, and 33S isotopes in natural abundance

✍ F Gerson; Ch Wydler; F Kluge 📂 Article 📅 1977 🏛 Elsevier Science ⚖ 648 KB

Rotational spectrum and hyperfine struct

Rotational spectrum and hyperfine structure in the X2Σ+ state of BaBr

✍ W.E. Ernst; G. Weiler; T. Törring 📂 Article 📅 1985 🏛 Elsevier Science 🌐 English ⚖ 347 KB

An ab initio determination of the magnet

An ab initio determination of the magnetic hyperfine structure of C2 in the four lowest triplet states

✍ H.U. Suter; B. Engels 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 606 KB

The magnetic hyperfine coupling constants of C, are calculated for the four lowest triplet states (311u, 3ZZ;, 'Xi, 311s) using various ab initio methods. The dependence of the hfcc's on the computational method is carefully studied to obtain an insight into the applicability of approximate methods

Hyperfine structure in the B3Π0+u state

Hyperfine structure in the B3Π0+u state of Br2 and the influence of the perturbing 1u state

✍ P. Liu; J. Kieckhäfer; E. Tiemann 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 404 KB