ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/OpenMD/branches/development/src/primitives/StuntDouble.cpp
(Generate patch)

Comparing:
trunk/src/primitives/StuntDouble.cpp (file contents), Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
branches/development/src/primitives/StuntDouble.cpp (file contents), Revision 1839 by gezelter, Fri Jan 25 15:21:04 2013 UTC

# Line 36 | Line 36
36   * [1]  Meineke, et al., J. Comp. Chem. 26, 252-271 (2005).            
37   * [2]  Fennell & Gezelter, J. Chem. Phys. 124, 234104 (2006).          
38   * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 24107 (2008).          
39 < * [4]  Vardeman & Gezelter, in progress (2009).                        
39 > * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010).
40 > * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41   */
42  
43   /**
# Line 61 | Line 62 | namespace OpenMD {
62    }
63  
64    void StuntDouble::zeroForcesAndTorques() {    
65 <    setFrc(V3Zero);
66 <    setTrq(V3Zero);
67 <    setParticlePot(0.0);
65 >    int sl = (snapshotMan_->getCurrentSnapshot()->*storage_).getStorageLayout();
66 >
67 >    if (sl & DataStorage::dslForce)
68 >      setFrc(V3Zero);
69 >    if (sl & DataStorage::dslTorque)
70 >      setTrq(V3Zero);
71 >    if (sl & DataStorage::dslParticlePot)
72 >      setParticlePot(0.0);
73 >    if (sl & DataStorage::dslFlucQForce)
74 >      setFlucQFrc(0.0);
75 >    if (sl & DataStorage::dslElectricField)
76 >      setElectricField(V3Zero);
77    }
78    void StuntDouble::addProperty(GenericData* genData) {
79      properties_.addProperty(genData);  

Comparing:
trunk/src/primitives/StuntDouble.cpp (property svn:keywords), Revision 1390 by gezelter, Wed Nov 25 20:02:06 2009 UTC vs.
branches/development/src/primitives/StuntDouble.cpp (property svn:keywords), Revision 1839 by gezelter, Fri Jan 25 15:21:04 2013 UTC

# Line 0 | Line 1
1 + Author Id Revision Date

Diff Legend

Removed lines
+ Added lines
< Changed lines
> Changed lines