Thursday, March 2, 2017

Density Functional Theory (DFT) - wiki

Density functional theory (DFT) is a computational quantum mechanical modelling method used in physicschemistry and materials science to investigate the electronic structure (principally the ground state) of many-body systems, in particular atoms, molecules, and the condensed phases













Further reading:

[B] Density functional theory

[C] Density functional theory

[HTML] Density functional theory

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