{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0705764 -0.3976709 -2.3500656 ] [ 0.1723942 -1.0212897 3.8685066 ] [ -1.1159529 0.3082083 0.7110927 ] [ -1.6635464 4.9167673 -0.347474 ] [ 2.6776815 -3.8060149 -1.8820597 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.130758580602291e-10 -6.371390187524947e-10 -3.765220161666325e-09 ] [ 2.762059568015193e-10 -1.636286480403846e-09 6.198030831930497e-09 ] [ -1.78795364629396e-09 4.938041325965126e-10 1.139296099161548e-09 ] [ -2.665295149696005e-09 7.87752961797394e-09 -5.567147191358592e-10 ] [ 4.290118697248675e-09 -6.09790809119645e-09 -3.015392050289862e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.536617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489240452372383e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2554708 0.1478059 2.1516799 ] [ 2.1835755 2.4983638 1.5884461 ] [ 1.8920491 1.7673703 3.9102191 ] [ 3.1848728 3.7465774 3.4014249 ] [ 4.0848908 1.5758404 2.830992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2554708e-10 1.478059e-11 2.1516799e-10 ] [ 2.1835755e-10 2.4983638e-10 1.5884461e-10 ] [ 1.8920491e-10 1.7673703e-10 3.9102191e-10 ] [ 3.1848728e-10 3.7465774e-10 3.4014249e-10 ] [ 4.0848908e-10 1.5758404e-10 2.830992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -6.2e-06 -1.1e-06 ] [ -1.7e-06 7.2e-06 -6.7e-06 ] [ -4.8e-06 -0.0 8.4e-06 ] [ -1e-07 8e-07 -6e-07 ] [ 6.6e-06 -1.7e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 -9.93349504896e-15 -1.76239428288e-15 ] [ -2.72370025536e-15 1.153567166976e-14 -1.073458335936e-14 ] [ -7.69044777984e-15 0.0 1.345828361472e-14 ] [ -1.6021766208e-16 1.28174129664e-15 -9.6130597248e-16 ] [ 1.057436569728e-14 -2.72370025536e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }