Intro to DFT - Day 1: Density-functional theory - Nicola Marzari

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  • Опубліковано 28 січ 2025

КОМЕНТАРІ • 7

  • @ignaciomartinalliati6293
    @ignaciomartinalliati6293 4 роки тому +34

    3:44 Introduction
    12:50 Quantum Mechanics in 5 minutes
    36:00 Hamiltonian in the adiabatic approximation
    43:18 Electronic wavefunction - Informational challenge - variational principle
    50:37 Hartree Equations
    1:05:21 Computers at the time
    1:10:05 Spin statistics - Exchange - Slater determinant
    1:16:18 Hartree-Fock Equations
    1:24:28 Reduced Density Matrices
    1:29:31 Density Functional Theory
    1:31:02 Thomas-Fermi approach - LDA
    1:41:44 First HK Theorem
    1:46:56 Second HK Theorem
    1:51:23 Kohn-Sham formalism
    Great talk!

  • @Dark-tk9xu
    @Dark-tk9xu 2 роки тому +4

    These lectures will be watched/rewatched for ages. Thanks to Prof. Marzari for giving us his own interpretations of this topic and expnations of the intemaditating and dare I say abstract equations. Will be looking forward to more such lectures (never ever in my life the phrase: 'will be looking forward' meant this much).

  • @yuyan9443
    @yuyan9443 4 роки тому +2

    Thanks for recording and uploading! I missing the streaming could review the webinar here.

    • @yuyan9443
      @yuyan9443 4 роки тому

      Unfortunately, the last few minutes about how to solve K-S equation doesnt covered here. But I learned the basic idea of DFT from the video updated here. Thanks again!

  • @purephysicstu
    @purephysicstu 4 роки тому +2

    Thanks sir nice explanation

  • @楚萱-o9w
    @楚萱-o9w 3 роки тому

    Thank you sir.

  • @vsksam
    @vsksam 4 роки тому

    Thanks