MRMD 0.4.0
Multi Resolution Molecular Dynamics
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BerendsenThermostat.hpp File Reference
#include "data/Atoms.hpp"
#include "datatypes.hpp"

Go to the source code of this file.

Namespaces

namespace  mrmd
 
namespace  mrmd::action
 
namespace  mrmd::action::BerendsenThermostat
 

Functions

void mrmd::action::BerendsenThermostat::apply (data::Atoms &atoms, const real_t &currentTemperature, const real_t &targetTemperature, const real_t &gamma)
 Berendsen Thermostat DOI: 10.1063/1.448118.