>>> Program Started OUTPUT FOR PERFECT CLUB BENCHMARK: MDG Revision: 1.* Author: kipp TEMPERATURE = 298.0 DENSITY = 0.998 G/C.C. NUMBER OF MOLECULES = 343 TIME STEP = 1.5000000000000002E-16 SEC ORDER USED TO SOLVE F=MA = 6 NO. OF TIME STEPS = 4 FREQUENCY OF DATA SAVING = -1 FREQUENCY TO WRITE RST FILE= 3000 SPHERICAL CUTOFF RADIUS = 10.872316668758277 ANGSTROM ***** NEW RUN STARTING FROM REGULAR LATTICE ***** RESTART 0 AFTER 0.0 SECONDS INTERMEDIATE RESULTS (ENERGY EXPRESSED IN UNITS OF KT ATOM) TIME KINETIC INTRA POT INTER POT REACT POT TOTAL 1 1.5111394119093615 0.004249030715255043 12.155652415005731 -4.8318266619131816 8.839214195717167 300.21302983265986 -22.494116740702967 2 1.5366236822287476 0.01701062595965674 12.122099425147551 -4.837816754806624 8.83791697852933 302.74446735105215 -22.61494010379797 3 1.5804481964551316 0.03850828784819836 12.06760238123569 -4.847933234146219 8.8386256313928 306.49043657706346 -22.805264654283377 4 1.6383655806071191 0.06914398425887275 11.99429608958068 -4.863362724692173 8.838442929754496 311.2399846029512 -23.063847300793675 execution time = 6.158 TOTAL CPU USED = 7.453 SECONDS ELAPSED CPU TIME IN SECONDS: 7.453 MFLOP RATE: 460.55950623909837 Total Time = 7.453 real 0m7.643s user 0m6.480s sys 0m0.180s