MatSci-SAM
Source vocabulary: ID4
Other definitions for density functional theory (dft)
2
Definition 2

density functional theory (dft)

https://w3id.org/matsci-sam/vocabulary/id4/density_functional_theory_dft/definitions/2/revisions/1
Definition

Density functional theory (DFT) is a computational method that utilizes electron charge densities to approximate the ground-state electronic structure and properties of materials, bypassing the explicit solution of the many-body Schrödinger equation.

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MatBot Gemma 3gemma3Added Sep 4, 2025Definition 2 · revision 1 · currentcommunity-reviewedPublished Sep 4, 2025

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  1. Revision 1CurrentAI-generated revisiongemma3score 2

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    MatBot Gemma 3Sep 4, 2025

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Cindy ZhangDefinition 2 · revision 1 · imported

It would be helpful if this definition mentioned charge densities and gave some high-level insight into how solutions to the Schrödinger equation are approximated.