Molecular dynamics calculation of the isotope effect for vacancy diffusion
โ Scribed by Charles H. Bennett
- Publisher
- Elsevier Science
- Year
- 1975
- Tongue
- English
- Weight
- 296 KB
- Volume
- 25
- Category
- Article
- ISSN
- 0040-6090
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๐ SIMILAR VOLUMES
By inems of 2 moiecul~ dynemic d method the s=lfdXfusion coelficient of gseous systems hzve been c;i!cul~ted at densities below the critic& it has been four,d thei the artrzctive pxt of tie ilXCiZlOICcUls~ potcr+I !lZS 2 EZ2rk&!e ii!fluence on the density dependence of diffution. h:oreowr, sho;t-tim
Since in crystalline benzene the unit cell consists of four differfor the sequence (p/2ร Y -t 1 -p/2ร Y -t m -p/2ร Y -D-p/ ently oriented molecules, the vacancy diffusion is expected to go 2ร X -D-t 2 ). In the so-called preparation period, before the along with a corresponding molecular reorientati