Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5386016 | Chemical Physics Letters | 2010 | 5 Pages |
Abstract
⺠Basis set sensitivity of spin population methods. ⺠Spin populations trend less than charge populations. ⺠MBS and the NPA methods trend the least with basis set choice.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Jordan J. Philips, Mathew A. Hudspeth, Philip M. Jr., Juan E. Peralta,