JDFTx  1.2.1
 All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Groups Pages
fluid-gummel-loop

Syntax:

fluid-gummel-loop [<maxIterations>=10] [<Atol>=1e-5]

Description:

Settings for the fluid <–> electron self-consistency loop:

  • <maxIterations>: Max number of electron and fluid minimization pairs
  • <Atol>: Free energy convergence criterion for this outer loop. Use fluid-solve-frequency to control whether such a loop is used at all.

Properties:

Requires:     (None)

Forbids:     (None)

Allow multiple:    no

Default:

fluid-gummel-loop 10 1.000000e-05

Back to: Input file documentation or Index of commands