{ "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" [ [ 0.4191919 0.8222526 0.2510936 ] [ 0.2848942 2.623705 0.3718827 ] [ 0.6213019 2.72569 2.983351 ] [ 2.411362 0.3472546 0.8650246 ] [ 2.114314 0.6145619 2.800723 ] [ 2.695562 2.69906 2.453497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.191919e-11 8.222526e-11 2.510936e-11 ] [ 2.848942e-11 2.623705000000001e-10 3.718827e-11 ] [ 6.213019e-11 2.72569e-10 2.983351e-10 ] [ 2.411362e-10 3.472546e-11 8.650246000000001e-11 ] [ 2.114314e-10 6.145619e-11 2.800723e-10 ] [ 2.695562e-10 2.69906e-10 2.453497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9150859 -12.4541135 0.3752908 ] [ 1.7510072 12.5405711 4.4549644 ] [ -2.9044459 -1.735435 -1.973373 ] [ 3.2371431 1.1655351 -5.2733168 ] [ -3.7130293 -0.4254639 6.190239 ] [ 2.5444108 0.9089063 -3.7738043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.466129235003727e-09 -1.995368948248966e-08 6.012821457613286e-10 ] [ 2.80542279869247e-09 2.009220982790014e-08 7.137639808176299e-09 ] [ -4.653435317358414e-09 -2.780473383918048e-09 -3.161692084717959e-09 ] [ 5.186474993004037e-09 1.86739308794179e-09 -8.44878489103187e-09 ] [ -5.948928736805389e-09 -6.816683135743891e-10 9.91785620296437e-09 ] [ 4.076595497471024e-09 1.456228424357831e-09 -6.046301020934509e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.523797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.006533475704518e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1413518 0.5751187 1.0275101 ] [ 1.0540815 2.7104147 0.5008803 ] [ 0.2779385 2.4025629 2.7308434 ] [ 2.5709368 0.8749445 0.5110144 ] [ 1.7947943 0.5670931 2.7409772 ] [ 2.7075232 2.7023903 2.2143466 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.413518e-11 5.751187e-11 1.0275101e-10 ] [ 1.0540815e-10 2.7104147e-10 5.008803e-11 ] [ 2.779385e-11 2.4025629e-10 2.7308434e-10 ] [ 2.5709368e-10 8.749445000000001e-11 5.110144e-11 ] [ 1.7947943e-10 5.670931000000001e-11 2.7409772e-10 ] [ 2.7075232e-10 2.7023903e-10 2.2143466e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 6e-06 8.9e-06 ] [ 2.6e-06 -2.68e-05 2.78e-05 ] [ 1.1e-06 -4.9e-06 -1.06e-05 ] [ 5e-07 7.8e-06 8.1e-06 ] [ -8.4e-06 3.38e-05 -3.33e-05 ] [ 5e-07 -1.59e-05 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 9.6130597248e-15 1.425937192512e-14 ] [ 4.16565921408e-15 -4.293833343744e-14 4.454051005824e-14 ] [ 1.76239428288e-15 -7.850665441919999e-15 -1.698307218048e-14 ] [ 8.010883104e-16 1.249697764224e-14 1.297763062848e-14 ] [ -1.345828361472e-14 5.415356978304e-14 -5.335248147264001e-14 ] [ 8.010883104e-16 -2.547460827072e-14 -1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.062777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.855281874092396e-18 } }