ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/group/trunk/OOPSE/libmdtools/Thermo.cpp
(Generate patch)

Comparing trunk/OOPSE/libmdtools/Thermo.cpp (file contents):
Revision 574 by gezelter, Tue Jul 8 20:56:10 2003 UTC vs.
Revision 582 by mmeineke, Wed Jul 9 15:33:46 2003 UTC

# Line 152 | Line 152 | double Thermo::getVolume() {
152  
153   double Thermo::getVolume() {
154  
155 <  double volume;
156 <  double Hmat[9];
157 <
158 <  entry_plug->getBoxM(Hmat);
159 <
160 <  // volume = h1 (dot) h2 (cross) h3
161 <
162 <  volume = Hmat[0] * ( (Hmat[4]*Hmat[8]) - (Hmat[7]*Hmat[5]) )
163 <         + Hmat[1] * ( (Hmat[5]*Hmat[6]) - (Hmat[8]*Hmat[3]) )
164 <         + Hmat[2] * ( (Hmat[3]*Hmat[7]) - (Hmat[6]*Hmat[4]) );
165 <
166 <  return volume;
155 >  return entry_plug->boxVol;
156   }
157  
158   double Thermo::getPressure() {

Diff Legend

Removed lines
+ Added lines
< Changed lines
> Changed lines