{ "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" [ "I" "I" "I" "I" ] } "a" { "source-value" [ 5.73484 5.350585 5.112439 4.939414 4.803437 4.691407 4.596139 4.513265 4.439926 4.374155 4.314534 4.26001 4.209781 4.163218 4.119824 4.079193 4.040996 4.004956 3.970844 3.938463 3.907646 3.878249 3.850147 3.82323 3.796019 3.767977 3.739053 3.70919 3.678323 3.646384 3.613296 3.578972 3.543316 3.506222 3.467567 3.427216 3.385011 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.73484e-10 5.350584999999999e-10 5.112439e-10 4.939414000000001e-10 4.803437e-10 4.691407e-10 4.5961390000000003e-10 4.513265e-10 4.439926e-10 4.3741550000000004e-10 4.3145340000000004e-10 4.2600100000000004e-10 4.2097810000000004e-10 4.1632179999999997e-10 4.1198240000000005e-10 4.079193e-10 4.040996e-10 4.004956e-10 3.970844e-10 3.938463e-10 3.907646e-10 3.878249e-10 3.8501470000000005e-10 3.82323e-10 3.796019e-10 3.767977e-10 3.7390530000000006e-10 3.70919e-10 3.6783229999999997e-10 3.646384e-10 3.613296e-10 3.578972e-10 3.543316e-10 3.5062220000000006e-10 3.467567e-10 3.427216e-10 3.385011e-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" [ 2.08091 3.1093 4.01932 4.85212 5.62585 6.3497 7.03199 7.67406 8.27724 8.84414 9.37423 9.86757 10.3245 10.7454 11.129 11.4749 11.7825 12.0521 12.2821 12.4717 12.6201 12.7271 12.793 12.8152 12.7902 12.7064 12.5485 12.2969 11.9265 11.4051 10.6916 9.73328 8.45738 6.7694 4.54297 1.60555 -2.2791 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 3.3339853794569396e-19 4.9816478080962e-19 6.439660588568879e-19 7.77395328936408e-19 9.0136054163889e-19 1.01733409729098e-18 1.126649006852166e-18 1.2295199619914039e-18 1.3261600522010161e-18 1.4169874455824758e-18 1.501917226774182e-18 1.580959008835938e-18 1.6541672657733e-18 1.7216028802983599e-18 1.7830623759786e-18 1.83848166574866e-18 1.8877646190105e-18 1.93095930106314e-18 1.96780936364514e-18 1.9981866326257798e-18 2.02196293387434e-18 2.0391062238581397e-18 2.0496645678761996e-18 2.05322140000368e-18 2.04921595841868e-18 2.03578971822576e-18 2.0104913491749e-18 1.97018058506346e-18 1.9108359625401e-18 1.8272984728433396e-18 1.7129831700074398e-18 1.559443378817952e-18 1.355021662085892e-18 1.08457745061996e-18 7.27864038296298e-19 2.5723746947187e-19 -3.6515207665494e-19 ] } }