Fixed unit conversion bug in Monte Carlo barostat where pV work was being...
Fixed unit conversion bug in Monte Carlo barostat where pV work was being divided by a factor of AVOGADRO*1e-25 (kJ/mol)/(bar nm^3), rather than multiplied by it. Checking this bug in since Peter Eastman is on vacation; he should double-check the fix upon return.
Showing
Please register or sign in to comment