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root/OpenMD/trunk/src/integrators/NPT.hpp
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Comparing trunk/src/integrators/NPT.hpp (file contents):
Revision 1782 by gezelter, Wed Aug 22 02:28:28 2012 UTC vs.
Revision 2011 by gezelter, Wed Aug 6 19:27:37 2014 UTC

# Line 35 | Line 35
35   *                                                                      
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).          
38 > * [3]  Sun, Lin & Gezelter, J. Chem. Phys. 128, 234107 (2008).          
39   * [4]  Kuang & Gezelter,  J. Chem. Phys. 133, 164101 (2010).
40   * [5]  Vardeman, Stocker & Gezelter, J. Chem. Theory Comput. 7, 834 (2011).
41   */
# Line 44 | Line 44
44   * @file NPT.hpp
45   * @author tlin
46   * @date 11/19/2004
47 – * @time 13:25am
47   * @version 1.0
48   */
49  
# Line 182 | Line 181 | namespace OpenMD {
181  
182      virtual void loadEta() = 0;
183      virtual void saveEta() = 0;
184 <            
184 >    RealType chiTolerance;    
185 >        
186 >
187 >  protected:    
188      int maxIterNum_;
189  
188 –    RealType chiTolerance;    
190    };
191  
192   }      //end namespace OpenMD

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