mcpele  1.0.0
The Monte Carlo Python Energy Landscape Explorer
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Public Member Functions
mcpele::RecordDisplacementPerParticleTimeseries Class Reference

#include <record_displacement_per_particle_timeseries.h>

Inheritance diagram for mcpele::RecordDisplacementPerParticleTimeseries:
mcpele::RecordScalarTimeseries mcpele::Action

List of all members.

Public Member Functions

 RecordDisplacementPerParticleTimeseries (const size_t niter, const size_t record_every, pele::Array< double > initial_coords, const size_t boxdimension)
virtual ~RecordDisplacementPerParticleTimeseries ()
virtual double get_recorded_scalar (pele::Array< double > &coords, const double energy, const bool accepted, MC *mc)

Detailed Description

Record time series of mean displacement per particle. Motivation: check if HS fluid is decorrelated between snapshots This is useful if particles are not placed back into periodic box.

Definition at line 14 of file record_displacement_per_particle_timeseries.h.


Constructor & Destructor Documentation

mcpele::RecordDisplacementPerParticleTimeseries::RecordDisplacementPerParticleTimeseries ( const size_t  niter,
const size_t  record_every,
pele::Array< double >  initial_coords,
const size_t  boxdimension 
) [inline]

Member Function Documentation

virtual double mcpele::RecordDisplacementPerParticleTimeseries::get_recorded_scalar ( pele::Array< double > &  coords,
const double  energy,
const bool  accepted,
MC mc 
) [inline, virtual]

The documentation for this class was generated from the following file:
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