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Variational Optimization of the Second-Order Density Matrix Corresponding to a Seniority-Zero Configuration Interaction Wave Function.
J Chem Theory Comput. 2015 Sep 8;11(9):4064-76. doi: 10.1021/acs.jctc.5b00378. Epub 2015 Aug 14.
J Chem Theory Comput. 2015.
PMID: 26575902
A hybrid configuration interaction treatment based on seniority number and excitation schemes.
Alcoba DR, Torre A, Lain L, Oña OB, Capuzzi P, Van Raemdonck M, Bultinck P, Van Neck D.
Alcoba DR, et al. Among authors: van raemdonck m.
J Chem Phys. 2014 Dec 28;141(24):244118. doi: 10.1063/1.4904755.
J Chem Phys. 2014.
PMID: 25554144
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Polynomial scaling approximations and dynamic correlation corrections to doubly occupied configuration interaction wave functions.
Van Raemdonck M, Alcoba DR, Poelmans W, De Baerdemacker S, Torre A, Lain L, Massaccesi GE, Van Neck D, Bultinck P.
Van Raemdonck M, et al.
J Chem Phys. 2015 Sep 14;143(10):104106. doi: 10.1063/1.4930260.
J Chem Phys. 2015.
PMID: 26374017
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