✦ LIBER ✦

A semi-empirical method for estimating molecular quadrupole polarizabilities

✍ Scribed by Eric A. Gislason; Malini S. Rajan

Publisher: Elsevier Science
Year: 1977
Tongue: English
Weight: 374 KB
Volume: 50
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(77)80174-7

No coin nor oath required. For personal study only.

✦ Synopsis

It IC demonstrated that a lo:+1c.g plot of (ticld-gradient) quadrupolc poldrizablhrlcs agm~s~ dqxAc pOi.lrizabllltle:b of "chern~celly smlthr" atoms can be well fit with n str.+t lint. The tiieorctical Justific2! tmn for thlb 1s dlscusscti. 'I Ile hypethesis is advanced that the average qundrupole polari~hility for a molecule can be estimated from the avcrdgc d~polc polnri-Lability using the be% tit to the atomic data This method works well for II 2. the only molecule with ;tn accurately known quadrupole polanzablhty.

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