ELPH_SELFEN_MU_RANGE

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Revision as of 08:51, 15 October 2025 by Csheldon (talk | contribs) (Created page with "{{DISPLAYTITLE:ELPH_SELFEN_MU_RANGE}} {{TAGDEF|ELPH_SELFEN_MU|A B C|[real array]}} Description: The range of chemical potentials at which to compute the phonon-mediated electron self-energy and transport coefficients. {{Available|6.5.0}} ---- A range of chemical potentials can be defined using {{TAG|ELPH_SELFEN_MU_RANGE}}, where: * A is the lower limit of the chemical potential range. * B is the upper limit of the chemical potential range. * C is the number of steps...")
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ELPH_SELFEN_MU = A B C
Default: ELPH_SELFEN_MU = [real array] 

Description: The range of chemical potentials at which to compute the phonon-mediated electron self-energy and transport coefficients.

Mind: Available as of VASP 6.5.0

A range of chemical potentials can be defined using ELPH_SELFEN_MU_RANGE, where:

  • A is the lower limit of the chemical potential range.
  • B is the upper limit of the chemical potential range.
  • C is the number of steps to take between the two.

This sets the chemical potential as a shift with respect to the Fermi level as alternative to ELPH_SELFEN_MU.

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