✦ LIBER ✦

The systematic cancellation of errors in a variation-perturbation approach to the calculation of intermolecular potentials

✍ Scribed by G.A. Gallup; J. Gerratt

Publisher: Elsevier Science
Year: 1985
Tongue: English
Weight: 203 KB
Volume: 117
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(85)80307-9

No coin nor oath required. For personal study only.

✦ Synopsis

We give B description or a variauon-perturbalion approach IO calculaling intermolecular pok.nlrals that possess a syslematic cancellation ol errors. An important consequence is the posabihty or uslog integrals over AOs that arc quile approximate.

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