Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5374456 | Chemical Physics | 2012 | 5 Pages |
Abstract
⺠A unified view of structural and energetic properties of AlP3, BP3 and GaP3 clusters is presented. ⺠Calculations made using DFT and CCSD(T) with extrapolation to the complete basis set. ⺠The characteristics of BP3 are apparently first described and its ground state has C2v symmetry.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Leonardo T. Ueno, Cinara Lopes, Thaciana Malaspina, Orlando Roberto-Neto, Sylvio Canuto, Francisco B.C. Machado,