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Rotational partition functions for spherical-top molecules

โœ Scribed by Robin S. McDowell

Publisher
Elsevier Science
Year
1987
Tongue
English
Weight
485 KB
Volume
38
Category
Article
ISSN
0022-4073

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๐Ÿ“œ SIMILAR VOLUMES

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## 2. Memory functions Let us consider a polar fiuid in equifibriom. where each molecule is isolated from the others <free ratation hypothesis). In this case. for ~nmctric role\_ the autocorrelation function OFT of rhe mokcilar dipole moment is well known I&9]. If motion is classically described,

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Tbc rotatlonal tifuslon tensors of cweral ngld molecules are determmed from the rotational fnctlon tensor. The molecular friction tensor IS modeled as a sum over the translational Stokes law fnctton coefficients of the constituent atoms of the molecule. Agreement of the theory w~tb expenmental rotat