{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Si" "Si" ] } "a" { "source-value" [ 4.8081 4.48594 4.286277 4.141212 4.027208 3.933282 3.85341 3.783927 3.72244 3.667297 3.617311 3.571598 3.529485 3.490447 3.454065 3.420001 3.387976 3.35776 3.32916 3.302011 3.276174 3.251528 3.227967 3.2054 3.190037 3.173868 3.156804 3.13874 3.119551 3.099088 3.077169 3.053572 3.028019 3.000154 2.969518 2.935498 2.897253 2.853583 2.80269 2.741701 2.665596 2.56432 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.8081e-10 4.4859400000000003e-10 4.2862770000000004e-10 4.1412120000000003e-10 4.0272080000000003e-10 3.933282e-10 3.85341e-10 3.783927e-10 3.7224400000000003e-10 3.667297e-10 3.617311e-10 3.5715979999999997e-10 3.5294850000000005e-10 3.490447e-10 3.454065e-10 3.4200010000000004e-10 3.387976e-10 3.35776e-10 3.32916e-10 3.302011e-10 3.276174e-10 3.251528e-10 3.227967e-10 3.2054e-10 3.190037e-10 3.1738680000000004e-10 3.156804e-10 3.13874e-10 3.119551e-10 3.099088e-10 3.077169e-10 3.053572e-10 3.028019e-10 3.0001540000000005e-10 2.969518e-10 2.935498e-10 2.8972530000000004e-10 2.853583e-10 2.8026900000000005e-10 2.7417010000000003e-10 2.665596e-10 2.56432e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.49735 2.02267 2.39876 2.69154 2.92953 3.12812 3.2967 3.44148 3.56678 3.67578 3.77084 3.85382 3.92617 3.98906 4.04343 4.09009 4.12969 4.16279 4.18988 4.21135 4.22757 4.23883 4.24542 4.24757 4.24653 4.2431 4.23674 4.22675 4.21222 4.19198 4.16445 4.12752 4.07826 4.01251 3.92422 3.80427 3.63831 3.40255 3.05473 2.51273 1.59605 -0.154426 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.39901916315488e-19 3.2406745855935367e-19 3.843237190910208e-19 4.312322461948032e-19 4.693624475932224e-19 5.011800731056896e-19 5.28189566579136e-19 5.513858796950784e-19 5.7146115275370245e-19 5.889248779204225e-19 6.041551688777473e-19 6.174500304771456e-19 6.290417783286337e-19 6.391178670968449e-19 6.478289013841345e-19 6.553046574967872e-19 6.616492769151553e-19 6.669524815300032e-19 6.7129277799575035e-19 6.747326512006081e-19 6.773313816795456e-19 6.791354325545664e-19 6.801912669476737e-19 6.805357349211456e-19 6.803691085525825e-19 6.798195619716481e-19 6.788005776408192e-19 6.772000031966401e-19 6.748720405666177e-19 6.716292350861184e-19 6.672184428490561e-19 6.613016045884416e-19 6.534092825543809e-19 6.428749712726208e-19 6.287293538875777e-19 6.095112453210816e-19 5.829215221222848e-19 5.451486061103041e-19 4.894216988856385e-19 4.0258372603827842e-19 2.5571539956278403e-19 -2.4741772684366084e-20 ] } }