{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.030246 0.3236526 0.7484261 ] [ 0.2346781 2.328783 2.431887 ] [ 2.977482 1.327807 0.9963536 ] [ 1.948854 0.1474915 2.662758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0246e-12 3.236526e-11 7.484261e-11 ] [ 2.346781e-11 2.328783e-10 2.431887e-10 ] [ 2.977482e-10 1.327807e-10 9.963536e-11 ] [ 1.948854e-10 1.474915e-11 2.662758e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.4853458 -18.1720535 -18.4925057 ] [ -2.7211115 20.1961078 15.7314021 ] [ 84.0669896 88.8306736 -126.2037927 ] [ -71.8605322 -90.8547279 128.9648963 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.519719928096347e-08 -2.911483926962681e-08 -2.962826029255074e-08 ] [ -4.359701227890019e-09 3.235773174831652e-08 2.520448465702403e-08 ] [ 1.346901653181568e-07 1.423224284518358e-07 -2.022007661202297e-07 ] [ -1.151332646490856e-07 -1.455653209305255e-07 2.066245417557564e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 53.887345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.633704431598378e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0333557 0.1067414 0.4388698 ] [ 0.3796551 2.6324295 2.5257235 ] [ 2.9383086 1.6380513 0.7040499 ] [ 1.8399407 -0.2494881 3.1707815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.33557e-12 1.067414e-11 4.388698e-11 ] [ 3.796551000000001e-11 2.6324295e-10 2.5257235e-10 ] [ 2.9383086e-10 1.6380513e-10 7.040499000000001e-11 ] [ 1.8399407e-10 -2.494881e-11 3.1707815e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 9e-07 2e-06 ] [ 1.6e-06 -2e-06 -1.3e-06 ] [ -2.2e-06 -3e-07 1.4e-06 ] [ -1.1e-06 1.5e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 1.44195895872e-15 3.2043532416e-15 ] [ 2.56348259328e-15 -3.2043532416e-15 -2.08282960704e-15 ] [ -3.52478856576e-15 -4.8065298624e-16 2.24304726912e-15 ] [ -1.76239428288e-15 2.4032649312e-15 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.5103029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.363500834230644e-18 } }