Density functional theory
id:
density-functional-theory-189-13021004
title:
Density functional theory
text:
Density functional theory (DFT) is a computational quantum mechanical modelling method used in physics, chemistry and materials science to investigate the electronic structure of many-body systems, in particular atoms, molecules, and the condensed phases. Using this theory, the properties of a many-electron system can be determined by using functionals, i.e. functions of another function. In the case of DFT, these are functionals of the spatially dependent electron density. DFT is among the most
brand slug:
wiki
category slug:
encyclopedia
description:
Computational quantum mechanical modelling method to investigate electronic structure
original url:
https://en.wikipedia.org/wiki/Density_functional_theory
date created:
2003-04-13T12:48:32Z
date modified:
2024-09-09T09:18:58Z
main entity:
{"identifier":"Q1048589","url":"https://www.wikidata.org/entity/Q1048589"}
image:
fields total:
13
integrity:
15