{ "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" [ [ 0.0704828 0.1905019 0.722746 ] [ 1.472209 1.144202 0.237838 ] [ 0.7786382 0.019786 2.199824 ] [ 0.3387255 2.988132 0.8463052 ] [ 1.126217 1.885786 2.703629 ] [ 2.677409 0.1439485 2.263239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.04828e-12 1.905019e-11 7.22746e-11 ] [ 1.472209e-10 1.144202e-10 2.37838e-11 ] [ 7.786382e-11 1.9786e-12 2.199824e-10 ] [ 3.387255e-11 2.988132e-10 8.463052e-11 ] [ 1.126217e-10 1.885786e-10 2.703629e-10 ] [ 2.677409e-10 1.439485e-11 2.263239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -58.1159488 -20.3624163 -43.8734386 ] [ 32.8093839 22.5734538 -25.3154337 ] [ 0.2540436 -30.8441185 52.6440709 ] [ -1.7772084 8.1142881 -1.0928263 ] [ -0.3095113 26.4184651 14.2090107 ] [ 27.139241 -5.8996723 3.4286169 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.31120144629698e-08 -3.262418733885684e-08 -7.029299759902429e-08 ] [ 5.256642782743193e-08 3.616665992906892e-08 -4.055979601955244e-08 ] [ 4.070227165838669e-10 -4.941772554988476e-08 8.434509961971762e-08 ] [ -2.847401748769375e-09 1.300052268825565e-08 -1.750900748455367e-09 ] [ -4.95891768733415e-10 4.232704714064073e-08 2.276534474823704e-08 ] [ 4.348185743645682e-08 -9.452317029441364e-09 5.493249838859772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 27.186497 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.355756989484934e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3309537 0.2918476 0.442516 ] [ 1.9884476 1.1137622 -0.1933185 ] [ 0.5046796 -0.3285763 2.6887389 ] [ 0.3209022 2.7112002 0.8682558 ] [ 1.1565288 2.0907783 3.1144817 ] [ 2.8240771 0.4933444 2.0529073 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.309537e-11 2.918476e-11 4.42516e-11 ] [ 1.9884476e-10 1.1137622e-10 -1.933185e-11 ] [ 5.046796e-11 -3.285763e-11 2.6887389e-10 ] [ 3.209022000000001e-11 2.7112002e-10 8.682558000000001e-11 ] [ 1.1565288e-10 2.0907783e-10 3.1144817e-10 ] [ 2.8240771e-10 4.933444e-11 2.0529073e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 -1.67e-05 -1e-06 ] [ -9.8e-06 8.8e-06 1.12e-05 ] [ -1.98e-05 -1.3e-05 -1e-06 ] [ 8e-06 6.7e-06 2.4e-06 ] [ 8.9e-06 1.07e-05 -6.8e-06 ] [ 7.6e-06 3.6e-06 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.17110076608e-15 -2.675634956736e-14 -1.6021766208e-15 ] [ -1.570133088384e-14 1.409915426304e-14 1.794437815296e-14 ] [ -3.172309709184e-14 -2.08282960704e-14 -1.6021766208e-15 ] [ 1.28174129664e-14 1.073458335936e-14 3.84522388992e-15 ] [ 1.425937192512e-14 1.714328984256e-14 -1.089480102144e-14 ] [ 1.217654231808e-14 5.76783583488e-15 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }