{ "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" [ [ 2.673592 1.767732 1.794498 ] [ 2.791934 4.53061 0.3856556 ] [ 2.184868 4.104179 2.619474 ] [ 3.820974 5.464835 2.237655 ] [ 4.399704 3.304978 2.526424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.673592000000001e-10 1.767732e-10 1.794498e-10 ] [ 2.791934e-10 4.53061e-10 3.856556e-11 ] [ 2.184868e-10 4.104179e-10 2.619474e-10 ] [ 3.820974e-10 5.464835e-10 2.237655e-10 ] [ 4.399704e-10 3.304978e-10 2.526424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9337078 -3.9061067 -0.5462136 ] [ -3.0818766 2.4472269 -10.0297318 ] [ -10.1322659 -0.6285233 5.1342059 ] [ 4.5998979 8.1287972 1.1871338 ] [ 9.5479523 -6.0413942 4.2546057 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.495964807818602e-09 -6.25827283309024e-09 -8.751306598830027e-10 ] [ -4.937710636710594e-09 3.92088972497286e-09 -1.60694018028543e-08 ] [ -1.623367954070907e-08 -1.007005336888065e-09 8.225904659353423e-09 ] [ 7.369848873447017e-09 1.30237688290645e-08 1.901998020121463e-09 ] [ 1.529750595157359e-08 -9.679380544276719e-09 6.816629783262418e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.61557777 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.862643113781997e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.8239523 1.9985468 2.6530787 ] [ 2.3170778 5.4193684 1.0212556 ] [ 1.2205401 3.4284537 1.6684691 ] [ 4.598112 5.2200906 1.6062271 ] [ 4.9113897 3.1058745 2.614676 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8239523e-10 1.9985468e-10 2.6530787e-10 ] [ 2.3170778e-10 5.4193684e-10 1.0212556e-10 ] [ 1.2205401e-10 3.4284537e-10 1.6684691e-10 ] [ 4.598112000000001e-10 5.2200906e-10 1.6062271e-10 ] [ 4.9113897e-10 3.1058745e-10 2.614676e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.64e-05 2.02e-05 2.1e-06 ] [ -9.7e-06 2.36e-05 -3.8e-06 ] [ -1.29e-05 -9.7e-06 -7.2e-06 ] [ -4.5e-06 -7.8e-06 -3e-06 ] [ 7e-07 -2.62e-05 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.229746278912e-14 3.236396774016e-14 3.36457090368e-15 ] [ -1.554111322176e-14 3.781136825088e-14 -6.08827115904e-15 ] [ -2.066807840832e-14 -1.554111322176e-14 -1.153567166976e-14 ] [ -7.2097947936e-15 -1.249697764224e-14 -4.8065298624e-15 ] [ 1.12152363456e-15 -4.197702746496e-14 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }