{ "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" [ [ -1.860390374476428e-08 -5.826201687216785e-08 -3.8301557392367e-09 ] [ -7.324948386345615e-08 2.319131015922629e-08 -7.996337631395705e-08 ] [ -4.667550317148234e-08 3.721554808543664e-08 6.607031179204482e-08 ] [ 7.99523176102673e-09 -1.823313395923225e-08 -2.269172200881103e-08 ] [ 3.810466686874287e-08 -1.147139175092816e-07 4.463129355123374e-08 ] [ 9.242899231015087e-08 1.308022102562364e-07 -4.216351441491465e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 60.495523 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.692451261366869e-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" [ [ -2.435308463616e-14 -3.412636202304e-14 4.8065298624e-16 ] [ 7.578295416384e-14 -2.050786074624e-14 9.13240673856e-15 ] [ 7.69044777984e-15 2.339177866368e-14 -2.435308463616e-14 ] [ -4.96674752448e-14 7.04957713152e-14 -4.96674752448e-15 ] [ 1.105501868352e-14 3.076179111936e-14 3.092200878144e-14 ] [ -2.066807840832e-14 -7.001511832895999e-14 -1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.652045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.507734056670954e-18 } }