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001 | | | vtls000008273 |
003 | | | IISER-K |
005 | | | 20140514140900.0 |
008 | | | 081127s2007 njua b 001 0 eng d |
020 | | | \a 9780471790563 |
020 | | | \a 0471790567 |
039 | | 9 | \a 201405141409 \b VLOAD \c 201405011711 \d VLOAD \c 200811271021 \d Siladitya \c 200811271021 \d Siladitya \y 200810161311 \z Vkt |
082 | 0 | 4 | \a 541 \b ADJ8 |
245 | 0 | 0 | \a Reduced-density-matrix mechanics : \b with applications to many-electron atoms and molecules / \c edited by David A. Mazziotti. |
260 | | | \a Hoboken, N.J. : \b Wiley, \c c2007. |
300 | | | \a xx, 574 p. : \b ill. ; \c 24 cm. |
490 | 1 | | \a Advances in chemical physics, \x 0065-2385 ; \v v. 134 |
504 | | | \a Includes bibliographical references and indexes. |
505 | 0 | 0 | \g Ch. 1. \t N-representability / \r John Coleman -- \g Ch. 2. \t Historical introduction / \r Mitja Rosina -- \g Ch. 3. \t Variational two-electron reduced-density-matrix theory / \r David A. Mazziotti -- \g Ch. 4. \t The lower bound method for density matrices and semidefinite programming / \r Robert M. Erdahl -- \g Ch. 5. \t The T1 and T2 representability conditions / \r Bastiaan J. Braams, Jerome K. Percus and Zhengji Zhao -- \g Ch. 6. \t Semidefinite programming : formulations and primal-dual interior-point methods / \r Mituhiro Fukuda, Maho Nakata and Makoto Yamashita -- \g Ch. 7. \t Theory and methodology of the contracted schrodinger EQUATION / \r C. Valdemoro -- \g Ch. 8. \t Contracted Schrodinger equation / \r David A. Mazziotti -- \g Ch. 9. \t Purification of correlated reduced density matrices : review and applications / \r D. R. Alcoba -- \g Ch. 10. \t Cumulants, extensivity, and the connected formulation of the contracted Schrodinger equation / \r John M. Herbert and John E. Harriman -- \g Ch. 11. \t Generalized normal ordering, irreducible Brillouin conditions, and contracted Schrodinger equations / \r Werner Kutzelnigg and Debashis Mukherjee -- \g Ch. 12. \t Anti-Hermitian formulation of the contracted Schrodinger theory / \r David A. Mazziotti -- \g Ch. 13. \t Canonical transformation theory for dynamic correlations in multireference problems / \r Garnet Kin-Lic Chan and Takeshi Yanai -- \g Ch. 14. \t Natural orbital functional theory / \r Mario Piris -- \g Ch. 15. \t Geminal functional theory / \r B. C. Rinderspacher -- \g Ch. 16. \t Linear inequalities for diagonal elements of density matrices / \r Paul W. Ayers and Ernest R. Davidson -- \g Ch. 17. \t Parameterization of the 2-RDM / \r A. John Coleman -- \g Ch. 18. \t Entanglement, electron correlation, and density matrices / \r Sabre Kais. |
650 | | 0 | \a Matrix mechanics. |
650 | | 0 | \a Electronic structure. |
650 | 1 | 7 | \a Reductieve groepen. \2 gtt |
650 | 1 | 7 | \a Dichtheid. \2 gtt |
650 | 1 | 7 | \a Veel-deeltjes-systemen. \2 gtt |
650 | 1 | 7 | \a Elektronendichtheid. \2 gtt |
650 | 1 | 7 | \a Representatie (wiskunde) \2 gtt |
650 | 1 | 7 | \a Schrodingervergelijking. \2 gtt |
650 | 1 | 7 | \a Elektroncorrelatie. \2 gtt |
700 | 1 | | \a Mazziotti, David A., \e ed. |
830 | | 0 | \a Advances in chemical physics, \x 0065-2385 ; \v v. 134 |
900 | | | \a AUTH \b TOC |
965 | | | \a oclcbatch |
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