Reduced-density-matrix mechanics
Subtitle: with applications to many-electron atoms and molecules
By: edited by David A. Mazziotti.
Contributors: Mazziotti, David A.
Series: Advances in chemical physics -- v. 134
Publisher: Wiley
Published: 2007
Place of publication: Hoboken, N.J
Language: eng
Number of pages: 574
ISBN-13: 9780471790563
Subjects: Matrix mechanics.; Electronic structure.
Notes: Includes bibliographical references and indexes.
Table of contents: title: N-representability / A. John Coleman; title: Historical introduction / Mitja Rosina; title: Variational two-electron reduced-density-matrix theory / David A. Mazziotti; title: The lower bound method for density matrices and semidefinite programming / Robert M. Erdahl; title: The T1 and T2 representability conditions / Bastian J. Braams, Jerome K. Percus, and Zhengji Zhao; title: Semidefinite programming : formulations and primal-dual interior-point methods / Mituhiro Fukuda, Maho Nakata, and Makoto Yamashita; title: Theory and methodology of the contracted Schrödinger equation / C. Valdemoro; title: Contracted Schrödinger equation / David A. Mazziotti; title: Purification of correlated reduced density matrices : review and applications / D.R. Alcoba; title: Cumulants, extensivity, and the connected formulation of the contracted Schrödinger equation / John M. Herbert and John E. Harriman; title: Generalized normal ordering, irreducible Brillouin conditions, and contracted Schrödinger equations / Werner Kutzelnigg and Debashis Mukherjee; title: Anti-Hermitian formulation of the contracted Schrödinger theory / David A. Mazziotti; title: Canonical transformation theory for dynamic correlations in multireference problems / Garnet Kin-Lic Chan and Takeshi Yanai; title: Natural orbital functional theory / Mario Piris; title: Geminal functional theory / B.C. Rinderspacher; title: Linear inequalities for diagonal elements of density matrices / Paul W. Ayers and Ernest R. Davidson; title: Parameterization of the 2-RDM / A. John Coleman; title: Entanglement, electron correlation, and density matrices / Sabre Kais.