Pairwise Spin-Contamination Correction Method and DFT Study of MnH and H2 Dissociation Curves

Satyender Goel, Artëm E. Masunov. Pairwise Spin-Contamination Correction Method and DFT Study of MnH and H2 Dissociation Curves. In Gabrielle Allen, Jaroslaw Nabrzyski, Edward Seidel, G. Dick van Albada, Jack Dongarra, Peter M. A. Sloot, editors, Computational Science - ICCS 2009, 9th International Conference, Baton Rouge, LA, USA, May 25-27, 2009, Proceedings, Part II. Volume 5545 of Lecture Notes in Computer Science, pages 141-150, Springer, 2009. [doi]

Abstract

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