Density functional

Views Updated: Dec 15, 2025

Key Facts

Abbreviation
DFT
Pronunciation
/ˈdɛnsɪti ˈfəŋkʃənəl/
Category
Miscellaneous
Related Field
Unclassified

Examples in Context

  1. The structure and vibrational frequencies of Ractopamine molecule in the THz range were simulated by density functional theory.
  2. Studies on structures and properties of capsaicin by density functional theory method
  3. This paper introduces a new gradation theory of electrical negativity-spin-polarized density functional theory non spin-polarized density functional theory.
  4. Topics covered include crystal structure and band theory, density functional theory, a survey of properties of metals and semiconductors, quantum Hall effect, phonons, electron phonon interaction and superconductivity.
  5. Theoretical Studies on Bond Dissociation Energies for Some Thiol Compounds by Density Functional Theory and CBS-Q Method

Other meanings of DFT

Density Functional Theory Academic
Density Function Theory Medical
Discrete Fourier Transform Academic
Design For Testability Academic
Department for Transport Misc
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Design For Test Misc
Dry Film Thickness Academic
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