PairDistributionInner

class PairDistributionInner : public feasst::ModelTwoBody

Compute PairDistribution from the inner two-body vistor

class PairDistribution : public feasst::Modify

Compute pair distributions. This class effectively functions as an Analyze because it does not change the System. However, the pair distance calculation utilizes Potential::energy, which requires a pointer to Configuration.

Arguments

  • dr: radial distribution bin size (default: 0.1).

  • print_intra: print the intramolecular distributions (default: false).