class rgpot::fortranpots::FeHePot

Overview

class FeHePot: public rgpot::Potential< FeHePot > {
public:
    // construction
 
    FeHePot();
 
    // methods
 
    void forceImpl(const ForceInput& in, ForceOut* out) const;
    virtual PotCaps caps() const;
};

Detailed Documentation

Methods

virtual PotCaps caps() const

Concurrency and evaluation capabilities of this potential.

Multi-threaded callers (NEB images, dimer endpoints) derive their sharing and cloning policy from this instead of hard-coded lists.