{ "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" [ [ -0.2817038 1.1317096 -0.4800583 ] [ 0.059649 -1.4760946 -1.5714615 ] [ -5.1049951 -2.7898127 2.1183737 ] [ 3.2537422 5.4341133 -0.0009663 ] [ 2.0733077 -2.2999156 -0.0658876 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.513392460690092e-10 1.813198677593486e-09 -7.691381912177621e-10 ] [ 9.5568234041466e-11 -2.364964277693576e-09 -2.517758896530591e-09 ] [ -8.179103865904492e-09 -4.469772721176452e-09 3.394008844220125e-09 ] [ 5.213069725899755e-09 8.706409355768631e-09 -1.5481832814342e-12 ] [ 3.321805152032281e-09 -3.68487103449209e-09 -1.055635731903384e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.365262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.98113338496881e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5459903 1.9809755 1.5872476 ] [ 3.0048365 4.1427689 0.4840597 ] [ 2.0591865 4.0480345 2.8486745 ] [ 3.8024333 5.6879585 2.2382279 ] [ 4.4586254 3.3125965 2.4054969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5459903e-10 1.9809755e-10 1.5872476e-10 ] [ 3.0048365e-10 4.1427689e-10 4.840597e-11 ] [ 2.0591865e-10 4.0480345e-10 2.8486745e-10 ] [ 3.8024333e-10 5.6879585e-10 2.2382279e-10 ] [ 4.4586254e-10 3.3125965e-10 2.4054969e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.67e-05 2.24e-05 4.1e-06 ] [ -2.22e-05 -3.72e-05 6.6e-06 ] [ -8.4e-06 3.2e-06 -2.46e-05 ] [ 1.62e-05 1.83e-05 2.93e-05 ] [ -2.3e-06 -6.6e-06 -1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.67563497878e-14 3.588875660159999e-14 6.568924199399999e-15 ] [ -3.55683212748e-14 -5.96009707848e-14 1.05743657844e-14 ] [ -1.34582837256e-14 5.1269652288e-15 -3.94135451964e-14 ] [ 2.59552614708e-14 2.93198324022e-14 4.69437753762e-14 ] [ -3.685006258199999e-15 -1.05743657844e-14 -2.46735201636e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }