public class DirectSamplingTargetQCArReferenceAzizAr
This class used the direct-sampling formulation of Mayer-Sampling Monte Carlo to compute the second
virial coefficient of argon, as described with a quantum potential (via Q-Chem), at a particular temperature.
The argon.in file (written via P2QChem.java) controls which quantum-mechanical description is employed.
The pair (true pair) potential of Aziz (1993) is employed as the reference system.
To test this simulation within Eclipse, one can set the boolean variable "practice" to true. This causes the
pair potential of Aziz to be used for both the reference and target systems. Q-Chem can only be used on CCR's U2.
Kate Shaul, 2009/2010