{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4974428 -16.655792 -4.2869295 ] [ -12.0322442 7.1386477 -6.1142017 ] [ -13.7628476 7.4039174 6.2533639 ] [ 14.6030205 -2.0419536 -3.2393855 ] [ 9.6946285 4.1551805 7.3871528 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.39916784514529e-09 -2.668552054330768e-08 -6.868418219917834e-09 ] [ -1.92777803529964e-08 1.143737444906769e-08 -9.796031018595615e-09 ] [ -2.205051266035339e-08 1.186238336061432e-08 1.001899344193471e-08 ] [ 2.339661803816312e-08 -3.271570318678395e-09 -5.190067713858518e-09 ] [ 1.553250713004137e-08 6.657333052304054e-09 1.183552351043726e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.9871051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.183693334292446e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0591621 -0.0604866 1.425519 ] [ 0.3197538 2.0807697 0.0771963 ] [ -0.0765307 2.0562265 2.5115218 ] [ 2.7311078 1.7378846 0.4662869 ] [ 2.3348227 1.7133378 2.9006134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0591621e-10 -6.048660000000001e-12 1.425519e-10 ] [ 3.197538e-11 2.0807697e-10 7.71963e-12 ] [ -7.653069999999999e-12 2.0562265e-10 2.5115218e-10 ] [ 2.7311078e-10 1.7378846e-10 4.662869e-11 ] [ 2.3348227e-10 1.7133378e-10 2.9006134e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -1.1e-06 -9e-07 ] [ -1.01e-05 1.2e-06 -1.83e-05 ] [ -1.96e-05 1.8e-06 1.7e-05 ] [ 2.01e-05 -1.2e-06 -1.62e-05 ] [ 1.19e-05 -7e-07 1.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 -1.76239428288e-15 -1.44195895872e-15 ] [ -1.618198387008e-14 1.92261194496e-15 -2.931983216064e-14 ] [ -3.140266176767999e-14 2.88391791744e-15 2.72370025536e-14 ] [ 3.220375007808e-14 -1.92261194496e-15 -2.595526125696e-14 ] [ 1.906590178752e-14 -1.12152363456e-15 2.948004982272e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }