Enter the name of the KIM Model you wish to perform calculations for: Enter the name of the species you wish to simulate: Enter the lattice type of the crystal ('bcc', 'diamond', 'fcc', 'hcp', or 'sc'): Enter the lattice constant 'a' in meters: If the lattice type is hcp, enter the lattice constant 'c' in meters (if you are not using hcp as the lattice, simply put any value here, as it will be ignored): Parameters Input: Ba LennardJones612_UniversalShifted__MO_959249795837_002 bcc [4.73294614255] Cell Size Min: 5 Cell Size Max: 7 Smallest System Size: 250 Largest System Size: 686 [Calculation] Calculating Size 5 ... Step Time Energy fmax MDMin: 0 02:59:47 -3745.122094 10.9179 MDMin: 1 02:59:47 -3747.355486 7.3522 MDMin: 2 02:59:47 -3744.879285 11.6449 MDMin: 3 02:59:47 -3740.239069 14.9411 MDMin: 4 02:59:48 -3730.675057 19.7931 MDMin: 5 02:59:48 -3716.627542 27.5400 MDMin: 6 02:59:48 -3671.294197 41.6687 MDMin: 7 02:59:48 -3363.648984 279.4239 MDMin: 8 02:59:49 786406777214.446045 6031674112505.6885