✦ LIBER ✦

Ab initio configuration interaction calculations for five states of ArHe+

✍ Scribed by M.Z. Liao; K. Balasubramanian; D. Chapman; S.H. Lin

Publisher: Elsevier Science
Year: 1987
Tongue: English
Weight: 548 KB
Volume: 111
Category: Article
ISSN: 0301-0104
DOI: 10.1016/0301-0104(87)85089-9

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab-initio configuration interaction calc

Ab-initio configuration interaction calculations of hydronium ion excited states

✍ R.C. Raffenetti; H.J.T. Preston; Joyce J. Kaufman 📂 Article 📅 1977 🏛 Elsevier Science 🌐 English ⚖ 575 KB

Ab initio restricted Hartree—Fock and co

Ab initio restricted Hartree—Fock and configuration interaction calculations for Li3

✍ D.W. Davies; Guillermo Del Conde 📂 Article 📅 1976 🏛 Elsevier Science 🌐 English ⚖ 381 KB

Ab initio configuration interaction calc

Ab initio configuration interaction calculations of the NIs (NO2) core-hole states of p-nitroaniline

✍ P.C. Ford; I.H. Hillier 📂 Article 📅 1982 🏛 Elsevier Science 🌐 English ⚖ 210 KB

The N Is (NOI) core-hole states of p-mtromlne are caiculacd by a CI procedure rhat rakes account of both orlmsl rcl~xat~on and corrclatlon effects A utelhte peak ammg from the ewlwtion Ibl(n) -Sbl(n) IS calcul3wd IO occur 2 6 cV from the mam lonrrauon peak. with a rclatwc mtcnsity of 66%. These resu

The Rydberg states of trans-1,3-5-hexatr

The Rydberg states of trans-1,3-5-hexatriene from ab initio and configuration interaction calculations

✍ Marco A.C. Nascimento; William A. Goddard III 📂 Article 📅 1980 🏛 Elsevier Science 🌐 English ⚖ 904 KB

The electronic states of propene studied

The electronic states of propene studied by electron impact spectroscopy and ab initio configuration interaction calculations

✍ Isobel C. Walker; Taher M. Abuain; Michael H. Palmer; Allan J. Beveridge 📂 Article 📅 1986 🏛 Elsevier Science 🌐 English ⚖ 635 KB

AB initio and configuration interaction

AB initio and configuration interaction calculations for some σ → π* superexcited states of the trans-1,3-butadiene molecule

✍ Edilson Clemete Da Silva; Marco Antonio-Chaer Nascimento 📂 Article 📅 1987 🏛 Elsevier Science 🌐 English ⚖ 266 KB

Some o +x\* supcrexcited states of the trans-l,3-butadiene molcule have been calculated in order to establish them as possible candidates for the 9.52 eV and 11.04 eV transitions observed in the electron impact spectra of this molecule. Four states have been solved self-consistently (7a, -r2a,, 2b,