{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "C" "C" "C" "C" ] } "a" { "source-value" [ 4.97502 4.641675 4.435082 4.28498 4.167019 4.069832 3.987186 3.915292 3.85167 3.794613 3.742891 3.695591 3.652017 3.611623 3.573978 3.538731 3.505594 3.474329 3.444736 3.416645 3.389911 3.364409 3.34003 3.31668 3.300784 3.284053 3.266397 3.247705 3.22785 3.206676 3.183997 3.15958 3.133139 3.104307 3.072607 3.037406 2.997834 2.952647 2.899987 2.836881 2.758133 2.65334 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.97502e-10 4.6416750000000004e-10 4.4350820000000005e-10 4.28498e-10 4.167019e-10 4.069832e-10 3.987186e-10 3.915292e-10 3.85167e-10 3.794613e-10 3.7428910000000003e-10 3.695591e-10 3.652017e-10 3.611623e-10 3.573978e-10 3.538731e-10 3.505594e-10 3.474329e-10 3.444736e-10 3.416645e-10 3.389911e-10 3.3644090000000006e-10 3.34003e-10 3.31668e-10 3.300784e-10 3.284053e-10 3.2663970000000003e-10 3.247705e-10 3.2278500000000004e-10 3.206676e-10 3.183997e-10 3.15958e-10 3.133139e-10 3.104307e-10 3.072607e-10 3.037406e-10 2.997834e-10 2.9526469999999997e-10 2.899987e-10 2.836881e-10 2.758133e-10 2.6533400000000004e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.419895 0.72171 0.969447 1.17874 1.35863 1.51497 1.65181 1.77214 1.87823 1.97184 2.05442 2.12712 2.19093 2.24666 2.295 2.33658 2.3719 2.40143 2.42557 2.44469 2.4591 2.46908 2.4749 2.4768 2.47588 2.47289 2.46734 2.45866 2.4461 2.42869 2.40515 2.3738 2.3323 2.27745 2.20464 2.10705 1.97424 1.78935 1.52345 1.12251 0.472873 -0.712051 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 6.727459521908161e-20 1.156306888997568e-19 1.5532253185046977e-19 1.888549670001792e-19 2.176765222317504e-19 2.427249515213376e-19 2.646491364003648e-19 2.8392812767845123e-19 3.0092561944851843e-19 3.159235947958272e-19 3.2915436933039363e-19 3.4080219336360965e-19 3.5102568238093438e-19 3.599546126886528e-19 3.6769953447360003e-19 3.743613848628864e-19 3.8002027268755204e-19 3.847515002487744e-19 3.886191546113856e-19 3.916825163103552e-19 3.93991252820928e-19 3.955902250884864e-19 3.96522691881792e-19 3.96827105439744e-19 3.9667970519063044e-19 3.962006543810112e-19 3.953114463564672e-19 3.9392075704961283e-19 3.91908423213888e-19 3.891190337170752e-19 3.85347509951712e-19 3.80324686245504e-19 3.7367565326918403e-19 3.64887714504096e-19 3.5322226652805123e-19 3.3758662488566406e-19 3.1630811718481923e-19 2.8668547364284804e-19 2.44083597295776e-19 1.7984592786142079e-19 7.576260652075584e-20 -1.1408314650172609e-19 ] } }