{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 38.455299 -60.2864026 6.4340949 ] [ 5.4994756 11.2341448 -70.5655998 ] [ 2.2184237 61.8635403 59.8933426 ] [ -6.0852907 -126.5653763 34.0520061 ] [ -40.0879076 113.7540938 -29.8138438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.161218100367361e-08 -9.658946479785634e-08 1.030855642478851e-08 ] [ 8.811131232980052e-09 1.799908415324189e-08 -1.130585542322892e-07 ] [ 3.554306587168633e-09 9.911631794857862e-08 9.595971325528468e-08 ] [ -9.749710490311667e-09 -2.027800869106144e-07 5.455732806475899e-08 ] [ -6.422790833351064e-08 1.822541496066502e-07 -4.776704351254303e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 41.725994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.685241206644108e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0627978 -0.2829424 2.4212809 ] [ -0.0193156 1.6688849 0.2077338 ] [ -0.0693949 2.5137043 3.358003 ] [ 2.8802192 0.3133492 2.3061514 ] [ 2.2240095 3.0213787 1.569505 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.279780000000001e-12 -2.829424e-11 2.4212809e-10 ] [ -1.93156e-12 1.6688849e-10 2.077338e-11 ] [ -6.93949e-12 2.5137043e-10 3.358003e-10 ] [ 2.8802192e-10 3.133492e-11 2.3061514e-10 ] [ 2.2240095e-10 3.0213787e-10 1.569505e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.15e-05 2.5e-06 -3e-06 ] [ -1.16e-05 1.31e-05 4.1e-06 ] [ -9.9e-06 1e-05 -8.8e-06 ] [ 1.73e-05 -1e-05 5.1e-06 ] [ -7.3e-06 -1.55e-05 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.84250311392e-14 4.005441552e-15 -4.8065298624e-15 ] [ -1.858524880128e-14 2.098851373248e-14 6.568924145279999e-15 ] [ -1.586154854592e-14 1.6021766208e-14 -1.409915426304e-14 ] [ 2.771765553984e-14 -1.6021766208e-14 8.17110076608e-15 ] [ -1.169588933184e-14 -2.48337376224e-14 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }