A primal-dual semidefinite programming algorithm tailored to the variational determination of the two-body density matrix

DOI10.1016/j.cpc.2011.02.005zbMath1262.81273arXiv1012.2059OpenAlexW2047397437MaRDI QIDQ1943145

Stijn De Baerdemacker, Dimitri Van Neck, Helen van Aggelen, Patrick Bultinck, Brecht Verstichel

Publication date: 15 March 2013

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1012.2059

zbMATH Keywords

semidefinite programmingdensity matrixvariational

Mathematics Subject Classification ID

Closed and approximate solutions to the Schrödinger, Dirac, Klein-Gordon and other equations of quantum mechanics (81Q05) Many-body theory; quantum Hall effect (81V70) Software, source code, etc. for problems pertaining to quantum theory (81-04) Variational principles of physics (49S05)

Related Items (1)

Variational determination of the two-particle reduced density matrix within the doubly occupied configuration interaction space: exploiting translational and reflection invariance

Cites Work

• Unnamed Item
• Reduced density matrices. Coulson's challenge
• Semidefinite Programming
• Theory of Superconductivity

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