{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.6116435 -36.364291 -2.3905952 ] [ -45.7187322 14.4748774 -49.9092143 ] [ -29.1325579 23.2281183 41.2378454 ] [ 4.9902312 -11.3802272 -14.163059 ] [ 23.7830626 -71.5987963 27.8566626 ] [ 57.6896399 81.6403189 -2.6316396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.860390389803798e-08 -5.826201735217648e-08 -3.830155770792556e-09 ] [ -7.324948446694341e-08 2.319131035029467e-08 -7.996337697275866e-08 ] [ -4.66755035560321e-08 3.72155483920478e-08 6.607031233638438e-08 ] [ 7.99523182689778e-09 -1.823313410945124e-08 -2.269172219576341e-08 ] [ 3.810466718267928e-08 -1.147139184543856e-07 4.463129391894169e-08 ] [ 9.242899307165409e-08 1.308022113338886e-07 -4.216351476229106e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 60.495523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.692451341220958e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2286399 0.2150052 2.494076 ] [ 0.7643339 2.6779852 0.8855275 ] [ 1.1196686 2.6138539 3.3888197 ] [ 3.1914427 1.1144689 0.1072279 ] [ 3.0495069 1.0062268 3.0919717 ] [ 3.0503553 3.2000384 1.8333761 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.286399e-11 2.150052e-11 2.494076e-10 ] [ 7.643339000000001e-11 2.6779852e-10 8.855275e-11 ] [ 1.1196686e-10 2.6138539e-10 3.3888197e-10 ] [ 3.1914427e-10 1.1144689e-10 1.072279e-11 ] [ 3.0495069e-10 1.0062268e-10 3.0919717e-10 ] [ 3.0503553e-10 3.2000384e-10 1.8333761e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.52e-05 -2.13e-05 3e-07 ] [ 4.73e-05 -1.28e-05 5.7e-06 ] [ 4.8e-06 1.46e-05 -1.52e-05 ] [ -3.1e-05 4.4e-05 -3.1e-06 ] [ 6.9e-06 1.92e-05 1.93e-05 ] [ -1.29e-05 -4.37e-05 -7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.43530848368e-14 -3.41263623042e-14 4.806529901999999e-16 ] [ 7.578295478819998e-14 -2.05078609152e-14 9.1324068138e-15 ] [ 7.690447843199998e-15 2.33917788564e-14 -2.43530848368e-14 ] [ -4.966747565399999e-14 7.049577189599999e-14 -4.9667475654e-15 ] [ 1.10550187746e-14 3.076179137279999e-14 3.09220090362e-14 ] [ -2.06680785786e-14 -7.001511890579999e-14 -1.13754541014e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.652045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.507734077331653e-18 } }