𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Aspects of finite-field calculations of polarizabilities for H2+

✍ Scribed by David M. Bishop; Sasha A. Solunac


Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
304 KB
Volume
122
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.

✦ Synopsis


Limilalions

to the rmlw-field melhod for calcukuing molecular polarizahilities and hyperpolarizahilitics are examined with rerercncc IO 111e hydrogen molecular ion.


πŸ“œ SIMILAR VOLUMES


Hyperpolarizabilities and polarizabiliti
✍ Edet F. Archibong; Ajit J. Thakkar πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 516 KB

The fmite&ld coupled-cluster doubla (CCD) model, supplemented by fourth-order singles and triples contributions corn. puted with CCD amplitudes, is used to calculate the dipole-dipole-quadrupole (8) and second dipole (y) hyperpolarizabilities, and the dipole (cr,) and quadrupole ((Ye) polarizabiliti

A numerical single-centre calculation of
✍ J.McI. Calvert; W.D. Davison πŸ“‚ Article πŸ“… 1969 πŸ› Elsevier Science 🌐 English βš– 234 KB

The parallel and perpendicular dipole polarizabilities of HZ+ are calculated for various icternuclear distances by a numerical single-centre procedure. \* This research was supported by the Advanced Research Projects Agency of the Department of Defense and was monitored by the Office of Naval Resear

Electron-correlated calculations of the
✍ SΕ‚awomir M. Cybulski; David M. Bishop πŸ“‚ Article πŸ“… 1996 πŸ› Elsevier Science 🌐 English βš– 390 KB

The effects of a uniform static electric field on the NMR shielding and magnetizability of H 2, N 2, HF, and CO are reported. The appropriate defining quantities are the shielding and magnetizability polarizabilities and these are calculated in a mixed numeric-analytic scheme with allowance for elec

A variation-perturbation calculation of
✍ J. Rychlewski πŸ“‚ Article πŸ“… 1980 πŸ› Elsevier Science 🌐 English βš– 243 KB

A varMlon-perturbation method has been used to calculate the dynamic polarizabllities al(w) and Q,,(W) of the hydrogen molecule. Values have been obtained for frequencies below the first exatation for a fned bond len@h of I.4 au.