Parameters

In this section, we will introduce all of the parameters which can be used in the atom.config.in file. The JASMINE component will parse this file and use the setting in it to override the default ones.

Classification of the parameters:

• Parameters for the diagonalization engine
  • ibasis
  • ictqmc
  • nmini
  • nmaxi
• Parameters for the eigensystems
  • nband
  • nspin
  • norbs
  • ncfgs
• Parameters for the Coulomb interaction
  • icu
  • Uc
  • Uv
  • Jz
  • Js
  • Jp
  • Ud
  • Jh
• Parameters for the spin-orbit coupling and crystal field splitting
  • icf
  • isoc
  • lambda
  • mune