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Real-space formulation of the electrostatic potential and total energy of solids

✍ Scribed by Pask, J. E.; Sterne, P. A.

Book ID
120549873
Publisher
The American Physical Society
Year
2005
Tongue
English
Weight
48 KB
Volume
71
Category
Article
ISSN
1098-0121

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✍ Thomas L. Beck πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 195 KB

A multigrid method for numerically solving electrostatics and quantum chemical problems in real space is discussed. Multigrid techniques are used to solve both the linear Poisson equation and the nonlinear Kohn᎐Sham and Poisson᎐Boltzmann Ž . equations. The electrostatic potential, Laplacian, charge