Commit 5702d7f8 by Francois Gygi

Removed commented code used in testing/development.


git-svn-id: http://qboxcode.org/svn/qb/trunk@227 cba15fb0-1239-40c8-b417-11db7ca47a34
parent e59028ff
......@@ -3,7 +3,7 @@
// PBEFunctional.C
//
////////////////////////////////////////////////////////////////////////////////
// $Id: PBEFunctional.C,v 1.3 2003-08-22 18:01:13 fgygi Exp $
// $Id: PBEFunctional.C,v 1.4 2004-05-20 00:19:26 fgygi Exp $
#include "PBEFunctional.h"
#include <cmath>
......@@ -453,69 +453,6 @@ void PBEFunctional::excpbe_sp(double rho_up, double rho_dn,
*vxc2_dndn = 2 * vx2_dn + vc2;
*vxc2_updn = vc2;
*vxc2_dnup = vc2;
// *exc_up = ec + h;
// *exc_dn = ec + h;
// *vxc1_up = vc1_up;
// *vxc1_dn = vc1_dn;
// *vxc2_upup = vc2;
// *vxc2_dndn = vc2;
// *vxc2_updn = vc2;
// *vxc2_dnup = vc2;
// *exc_up = ex_up ;
// *exc_dn = ex_dn ;
// *vxc1_up = vx1_up ;
// *vxc1_dn = vx1_dn ;
// *vxc2_upup = 2 * vx2_up ;
// *vxc2_updn = 0.0;
// *vxc2_dnup = 0.0;
// *vxc2_dndn = 2 * vx2_dn ;
// *exc_up = ec;
// *exc_dn = ec;
// *vxc1_up = vc1_up;
// *vxc1_dn = vc1_dn;
// *vxc2_upup = 0.0;
// *vxc2_updn = 0.0;
// *vxc2_dnup = 0.0;
// *vxc2_dndn = 0.0;
// *exc_up = rhotot;
// *exc_dn = rhotot;
// *vxc1_up = 2 * rhotot;
// *vxc1_dn = 2 * rhotot;
// *vxc2_upup = 0.0;
// *vxc2_updn = 0.0;
// *vxc2_dnup = 0.0;
// *vxc2_dndn = 0.0;
// *exc_up = rh13;
// *exc_dn = rh13;
// *vxc1_up = (4./3.) * rh13;
// *vxc1_dn = (4./3.) * rh13;
// *vxc2_upup = 0.0;
// *vxc2_updn = 0.0;
// *vxc2_dnup = 0.0;
// *vxc2_dndn = 0.0;
// *exc_up = grad * grad;
// *exc_dn = grad * grad;
// *vxc1_up = grad * grad;
// *vxc1_dn = grad * grad;
// *vxc2_upup = -2.0 * rhotot;
// *vxc2_dnup = -2.0 * rhotot;
// *vxc2_updn = -2.0 * rhotot;
// *vxc2_dndn = -2.0 * rhotot;
// *exc_up = grad_up * grad_up;
// *exc_dn = grad_dn * grad_dn;
// *vxc1_up = grad_up * grad_up;
// *vxc1_dn = grad_dn * grad_dn;
// *vxc2_upup = -2.0 * rho_up;
// *vxc2_dnup = 0.0;
// *vxc2_updn = 0.0;
// *vxc2_dndn = -2.0 * rho_dn;
}
////////////////////////////////////////////////////////////////////////////////
......
Markdown is supported
0% or
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment