{ "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" [ [ -13.588747 -28.1061242 3.8969271 ] [ -36.3920786 19.4022153 -41.3049124 ] [ -23.5739558 13.2268786 29.0945369 ] [ 5.8177178 -11.2356572 -15.6700068 ] [ 25.5147151 -49.6766741 22.6497051 ] [ 42.2223486 56.3893616 1.3337501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.177157274936614e-08 -4.50309750945411e-08 6.243565492581944e-09 ] [ -5.830653751523599e-08 3.108577574538806e-08 -6.617776497147202e-08 ] [ -3.776964084253257e-08 2.119179565907983e-08 4.661458681418291e-08 ] [ 9.32101144557201e-09 -1.800150728516319e-08 -2.510611854273702e-08 ] [ 4.087908001959274e-08 -7.959080584212088e-08 3.628882797923453e-08 ] [ 6.764765980218761e-08 9.034571681735728e-08 2.136903228209662e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 40.368583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.467759989742433e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0438117 0.2771993 2.7555995 ] [ 1.4294889 3.017953 0.5543544 ] [ 0.4237567 2.5887638 2.911892 ] [ 2.0495677 0.7063942 0.3980744 ] [ 3.5386935 0.9628515 2.5124054 ] [ 2.9186289 3.2744165 2.6686732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0438117e-10 2.771993e-11 2.7555995e-10 ] [ 1.4294889e-10 3.017953e-10 5.543544e-11 ] [ 4.237567e-11 2.5887638e-10 2.911892e-10 ] [ 2.0495677e-10 7.063942e-11 3.980744e-11 ] [ 3.5386935e-10 9.628515e-11 2.5124054e-10 ] [ 2.9186289e-10 3.2744165e-10 2.6686732e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -8e-07 8.1e-06 ] [ 2e-06 -2e-06 -3.05e-05 ] [ -2.96e-05 -9.4e-06 1.1e-05 ] [ -1.17e-05 -9.3e-06 -1.6e-05 ] [ -3.2e-06 1.69e-05 -1.4e-06 ] [ 3.89e-05 4.5e-06 2.88e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -1.28174129664e-15 1.297763062848e-14 ] [ 3.2043532416e-15 -3.2043532416e-15 -4.88663869344e-14 ] [ -4.742442797568e-14 -1.506046023552e-14 1.76239428288e-14 ] [ -1.874546646336e-14 -1.490024257344e-14 -2.56348259328e-14 ] [ -5.126965186560001e-15 2.707678489152e-14 -2.24304726912e-15 ] [ 6.232467054911999e-14 7.2097947936e-15 4.614268667904e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }