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A linked electron pair functional.
Knowles PJ, Cooper B. Knowles PJ, et al. J Chem Phys. 2010 Dec 14;133(22):224106. doi: 10.1063/1.3507876. J Chem Phys. 2010. PMID: 21171682
Approximate variational coupled cluster theory.
Robinson JB, Knowles PJ. Robinson JB, et al. Among authors: knowles pj. J Chem Phys. 2011 Jul 28;135(4):044113. doi: 10.1063/1.3615060. J Chem Phys. 2011. PMID: 21806096
Quasi-variational coupled cluster theory.
Robinson JB, Knowles PJ. Robinson JB, et al. Among authors: knowles pj. J Chem Phys. 2012 Feb 7;136(5):054114. doi: 10.1063/1.3680560. J Chem Phys. 2012. PMID: 22320732 Free article.
What Is the Price of Open-Source Software?
Krylov AI, Herbert JM, Furche F, Head-Gordon M, Knowles PJ, Lindh R, Manby FR, Pulay P, Skylaris CK, Werner HJ. Krylov AI, et al. Among authors: knowles pj. J Phys Chem Lett. 2015 Jul 16;6(14):2751-4. doi: 10.1021/acs.jpclett.5b01258. J Phys Chem Lett. 2015. PMID: 26266858 No abstract available.
46 results