Changes between Version 10 and Version 11 of ApplicationExamples


Ignore:
Timestamp:
Apr 15, 2015, 9:54:17 AM (10 years ago)
Author:
FrederikHeber
Comment:

added FittingPotentials

Legend:

Unmodified
Added
Removed
Modified

  • ApplicationExamples

    v10 v11  
    1717 * CenteringMolecules - how to center molecules with respect to the boundary
    1818 * FragmentationAutomation - how to calculate a molecular system's energy with the BOSSANOVA ansatz and [http://www.mpqc.org MPQC]
     19 * FittingPotentials - how to fit constant and Morse potentials to a brief water molecule MD simulation