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Relativistic and Electron Correlation Effects in Molecules and Solids

by G.L. Malli

Relativistic and Electron Correlation Effects in Molecules and Solids cover
  • ISBN: 9780306446252
  • ISBN10: 0306446251

Relativistic and Electron Correlation Effects in Molecules and Solids

by G.L. Malli

  • List Price: $319.00
  • Binding: Hardcover
  • Publisher: Kluwer Academic Pub
  • Publish date: 05/01/1994
  • ISBN: 9780306446252
  • ISBN10: 0306446251
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Description: Relativistic and Electron Correlation Effects in Molecules of Heavy Elements.- Polyatomic Molecular Dirac-Hartree-Fock Calculations with Gaussian Basis Sets: Theory, Implementation and Applications.- Molecular Electronic Structure Calculations based on the Dirac-Coulomb-(Breit) Hamiltonian.- Electronic Structure of Molecules, Clusters and Surfaces using Ab Initio Relativistic Effective Core and Core/Valence Polarization Potentials.- Configuration Interaction Wave Functions.- Full Configuration Interaction and Mller-Plesset Theory.- A Discussion of Some Aspects of the MCSCF Method.- Electron Correlation in Molecules Using Direct Second Order MCSCF.- Algebraic Approach to Coupled Cluster Theory.- Correlated and Non-Correlated Wave Functions for Organometallics.- Modern Tools for Including Electron Correlation in Electronic Structure Studies: Hondo and Chem-Station.- Multiconfigurational Perturbation Theory.- Density Functional Theory, The Modern Treatment of Electron Correlations.- Density Functional Theory, Its Gaussian Implementation and Applications to Complex Systems.- An Introduction to GUGA in the Columbus Program System.- The Unitary Group Approach in Context.- Participants.
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Product notice Returnable at the third party seller's discretion and may come without consumable supplements like access codes, CD's, or workbooks.
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Seller: Scholars Attic
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Sewn binding. Cloth over boards. 484 p. Contains: Illustrations. Advances in Experimental Medicine & Biology, 318. Audience: General/trade.
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Sewn binding. Cloth over boards. 484 p. Contains: Illustrations. Advances in Experimental Medicine & Biology, 318. Audience: General/trade.
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1994. Hardcover. Dec. cloth, no d.j. (as issued). Some shelf-wear. Else clean copy. Very Good.
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1994. Hardcover. Dec. cloth, no d.j. (as issued). Some shelf-wear. Else clean copy. Very Good.
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