{ "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" [ "Mg" "Mg" ] } "a" { "source-value" [ 5.35325 4.994562 4.772261 4.610748 4.483818 4.379242 4.290313 4.212953 4.144494 4.083099 4.027444 3.976549 3.929661 3.886197 3.84569 3.807763 3.772107 3.738465 3.706622 3.676396 3.647629 3.620188 3.593956 3.56883 3.551725 3.533723 3.514724 3.494611 3.473247 3.450463 3.426059 3.399787 3.371336 3.340311 3.306202 3.268325 3.225743 3.177122 3.120458 3.052554 2.967819 2.85506 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.35325e-10 4.994562000000001e-10 4.772261e-10 4.610748e-10 4.4838180000000006e-10 4.3792419999999997e-10 4.290313e-10 4.212953e-10 4.144494e-10 4.083099e-10 4.027444e-10 3.9765490000000003e-10 3.929661e-10 3.886197e-10 3.84569e-10 3.807763e-10 3.772107e-10 3.7384650000000003e-10 3.706622e-10 3.676396e-10 3.647629e-10 3.6201880000000004e-10 3.593956e-10 3.5688300000000004e-10 3.551725e-10 3.5337230000000005e-10 3.514724e-10 3.494611e-10 3.4732470000000005e-10 3.450463e-10 3.426059e-10 3.399787e-10 3.371336e-10 3.3403109999999997e-10 3.306202e-10 3.268325e-10 3.2257430000000003e-10 3.177122e-10 3.1204580000000003e-10 3.052554e-10 2.967819e-10 2.85506e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.329898 0.49788 0.633005 0.746681 0.844479 0.929726 1.00489 1.0729 1.1337 1.18664 1.23321 1.27427 1.31036 1.34189 1.3692 1.3926 1.41235 1.42869 1.44185 1.45209 1.45977 1.46532 1.46891 1.47022 1.46954 1.4673 1.46319 1.45689 1.44799 1.43595 1.41987 1.39843 1.36992 1.33209 1.2818 1.21428 1.12219 0.99356 0.807769 0.526252 0.0688021 -0.768596 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.285548628486785e-20 7.97691695963904e-20 1.0141858118495041e-19 1.196314841395565e-19 1.3530045105565632e-19 1.489585260949901e-19 1.6100112644757123e-19 1.7189752964563201e-19 1.81638763500096e-19 1.901206865306112e-19 1.9758202305367679e-19 2.041605602586816e-19 2.099428156831488e-19 2.1499447856853122e-19 2.19370022919936e-19 2.23119116212608e-19 2.26283415038688e-19 2.289013716370752e-19 2.31009836070048e-19 2.3265046492974725e-19 2.338809365745216e-19 2.347701445990656e-19 2.353453260059328e-19 2.355552111432576e-19 2.3544626313304323e-19 2.3508737556998403e-19 2.344288809788352e-19 2.334195097077312e-19 2.319935725152192e-19 2.3006455186377604e-19 2.2748825185752963e-19 2.2405318518253443e-19 2.194853796366336e-19 2.1342434548014722e-19 2.0536699925414401e-19 1.9454910271050242e-19 1.7979465820955522e-19 1.591858603362048e-19 1.2941886068069952e-19 8.431486510492418e-20 1.102331160819437e-20 -1.2314265420403967e-19 ] } }