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Full-Potential Electronic Structure Method
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Full-Potential Electronic Structure Method

This is a book describing electronic structure theory and application within the framework of a methodology implemented in the computer code RSPt. In 1986, when the code that was to become RSPt was developed enough to be useful, it was one of the ?rst full-potential, all-electron, relativistic implem- tations of DFT (density functional theory).
Alaotsikko
Energy and Force Calculations with Density Functional and Dynamical Mean Field Theory
Painos
2010
ISBN
9783642151439
Kieli
englanti
Paino
446 grammaa
Julkaisupäivä
2.12.2010
Sivumäärä
200