sc_PsiHSOSHF man page on DragonFly

sc_PsiHSOSHF man page on DragonFly

Man page or keyword search:
man Server 44335 pages
apropos Keyword Search (all sections)
Output format

sc::PsiHSOSHF(3)		     MPQC		      sc::PsiHSOSHF(3)

NAME
       sc::PsiHSOSHF - PsiHSOSHF is a concrete implementation of Psi ROHF wave
       function.

SYNOPSIS
       #include <psiwfn.h>

       Inherits sc::PsiSCF.

   Public Member Functions
       PsiHSOSHF (const Ref< KeyVal > &)
       PsiHSOSHF (StateIn &)
       void write_basic_input (int conv)
	   Writes out Psi input file entries specific to this PsiWavefunction.
       int spin_polarized ()
	   Return 1 if the alpha density is not equal to the beta density.
       int gradient_implemented () const
       PsiSCF::RefType reftype () const
	   Returns the PsiSCF::RefType of this particular Psi SCF wave
	   function.

   Protected Member Functions
       void write_input (int conv)
	   Prepares a complete Psi input file. The input file is assumed to
	   have been opened.

   Additional Inherited Members
Detailed Description
       PsiHSOSHF is a concrete implementation of Psi ROHF wave function.

Member Function Documentation
   void sc::PsiHSOSHF::write_basic_input (int conv) [virtual]
       Writes out Psi input file entries specific to this PsiWavefunction. The
       input file is assumed to have been opened.

       Reimplemented from sc::PsiWavefunction.

Author
       Generated automatically by Doxygen for MPQC from the source code.

Version 2.3.1			Fri Feb 19 2016		      sc::PsiHSOSHF(3)

[top]

List of man pages available for DragonFly

Copyright (c) for man pages and the logo by the respective OS vendor.

For those who want to learn more, the polarhome community provides shell access and support.

[legal] [privacy] [GNU] [policy] [cookies] [netiquette] [sponsors] [FAQ]

Polarhome, production since 1999.
Member of Polarhome portal.
Based on Fawad Halim's script.
....................................................................

Vote for polarhome