1 #ifndef DDMD_EXTERNAL_ENERGY_ANALYZER_H 2 #define DDMD_EXTERNAL_ENERGY_ANALYZER_H 11 #include <ddMd/analyzers/AverageAnalyzer.h> 49 virtual void compute();
56 virtual double value();
Parallel domain decomposition (DD) MD simulation.
Main object for a domain-decomposition MD simulation.
Analyze average and block averages of a single floating point variable.
Utility classes for scientific computation.
Output and evaluate average of external energy.