The Buckingham potential has been modified to include the RM8 and R -lo dispersion terms All the potential parameters are known for the rare gas dimers either from SCF or TFD celculations at short distances or perturbation calculations at long distances. Computed well potential parametersRo and R, a
✦ LIBER ✦
Comment on the modified Buckingham, Carrá, Konowalow potential for nonpolar molecules
✍ Scribed by D.D. Konowalow
- Book ID
- 107731279
- Publisher
- Elsevier Science
- Year
- 1968
- Tongue
- English
- Weight
- 213 KB
- Volume
- 2
- Category
- Article
- ISSN
- 0009-2614
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📜 SIMILAR VOLUMES
On the validity of a modified Buckingham
On the validity of a modified Buckingham potential for the rare gas dimers at intermediate distances
✍
J.Peter Toennies
📂
Article
📅
1973
🏛
Elsevier Science
🌐
English
⚖ 342 KB
Comment ON “A modified LEPS potential en
✍
F.E. Budenholzer; D.C. Jeng
📂
Article
📅
1989
🏛
Elsevier Science
🌐
English
⚖ 319 KB
mass velocity flux contour maps are calculated from quasiclassical trajectory results for the F + H2 reaction at a relative translation energy of 3.0 kcal/mol. Results using a modified LEPS surface (T. Takayanagi and S. Sato, Chem. Phys. Letters 144 ( 1988) 191) and the number five surface of Mucker