Solving the Schrödinger equation : has everything been tried? /

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The Schrodinger equation is the master equation of quantum chemistry. The founders of quantum mechanics realised how this equation underpins essentially the whole of chemistry. However, they recognised that its exact application was much too complicated to be solvable at the time. More than two gene...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Popelier, Paul L. A.
Formato: Electrónico eBook
Idioma:Inglés
Publicado: London : Imperial College Press, ©2011.
Temas:
Schrödinger equation.
Wave functions.
Wave mechanics.
Équation de Schrödinger.
Fonction d'onde.
Mécanique ondulatoire.
SCIENCE > Waves & Wave Mechanics.
Schrödinger equation
Wave functions
Wave mechanics
Acceso en línea:Texto completo
Tabla de Contenidos:
  • 1. Intracule functional theory / Deborah L. Crittenden and Peter M.W. Gill
  • 2. Explicitly correlated electronic structure theory / Frederick R. Manby
  • 3. Solving problems with strong correlation using the Density Matrix Renormalization Group (DMRG) / Garnet Kin-Lic Chan and Sandeep Sharma
  • 4. Reduced-density-matrix theory for many-electron correlation / David A. Mazziotti
  • 5. Finite size scaling for criticality of the Schrodinger equation / Sabre Kais
  • 6. The generalized Sturmian method / James Avery and John Avery
  • 7. Slater-type orbital basis sets : reliable and rapid solution of the Schrodinger equation for accurate molecular properties / Philip E. Hoggan
  • 8. Modern Ab Initio valence bond methods / Philippe C. Hiberty and Sason Shaik
  • 9. Quantum Monte Carlo approaches for tackling electronic correlation / Massimo Mella and Gabriele Morosi
  • 10. Solving the Schrodinger equation on real-space grids and with random walks / Thomas L. Beck and Joel H. Dedrick
  • 11. Changes in dense linear algebra kernels : decades-long perspective / Piotr Luszczek, Jakub Kurzak, and Jack Dongarra.

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