fire.h

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#ifndef FIRE_H
#define FIRE_H
 
#include "md_base.h"
 
class FIRE : public MD_base
{
  public:
    FIRE(const Parameter& param_in, UnitCell& unit_in);
 
    ~FIRE();
 
  private:
 
    void setup(ModuleESolver::ESolver* p_esolver, const std::string& global_readin_dir);
 
    void first_half(std::ofstream& ofs);
 
    void second_half();
 
    void print_md(std::ofstream& ofs, const bool& cal_stress);
 
    void restart(const std::string& global_readin_dir);
 
    void write_restart(const std::string& global_out_dir);
 
    void check_force(void);
 
    void check_fire(void);
 
    double max;         
    double alpha_start; 
    double alpha;       
    double finc;        
    double fdec;        
    double f_alpha;     
    int n_min;          
    double dt_max;      
    int negative_count; 
    double force_thr;   
};
 
#endif