PSI4 Project Logo

CLAG

Solves for the CI Lagrangian. Called whenever CI properties or gradients are requested.

General

CAS_FILES_WRITE

Do write the OEI, TEI, OPDM, TPDM, and Lagrangian files in canonical form, Pitzer order?

FOLLOW_ROOT

Root to get OPDM

  • Type: integer
  • Default: 1

Expert

WFN

Wavefunction type

  • Type: string
  • Default: NONE

Table Of Contents

Previous topic

WFN

Next topic

CAS_FILES_WRITE

This Page