Synopsis

This analyzer computes time averages of the components of the virial stress tensor.

BUG: This analyzer requires an nSamplePerBlock parameter, but then does nothing with it, and does not output block averages.

See also: DdMd::VirialStressTensorAverage

Parameters

The parameter file format is:

VirialStressTensorAverage{
  interval           int
  outputFileName     string
  nSamplePerBlock    int
}

in which

interval	number of steps between data samples
outputFileName	name of output file
nSamplePerBlock	number of data samples per block average, if nSamplePerBlock > 0.

Output

At the end of the simulation, parameters are echoed to file {outputFileName}.prm and the average of each stress component is output to {outputFileName}.dat.