{ "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" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8634691 0.8481608 -0.9773919 ] [ 1.1604034 -0.1176667 1.1673809 ] [ 0.5650542 -0.0089165 0.3796131 ] [ -0.8619884 -0.7215776 -0.5696021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.383430016201009e-09 1.358903415634747e-09 -1.565954464440864e-09 ] [ 1.859171213494156e-09 -1.885228373398878e-10 1.87035040095789e-09 ] [ 9.053166361835626e-10 -1.4285807957061e-11 6.082072387803054e-10 ] [ -1.381057673259045e-09 -1.156094770337798e-09 -9.126031752973312e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.977832 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079277919037749e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2255046 4.6589229 1.6445932 ] [ 2.6588247 2.8334758 2.9988711 ] [ 4.1202235 3.3789729 1.289825 ] [ 3.9716782 4.7319505 3.1610486 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2255046e-10 4.6589229e-10 1.6445932e-10 ] [ 2.6588247e-10 2.8334758e-10 2.9988711e-10 ] [ 4.1202235e-10 3.3789729e-10 1.289825e-10 ] [ 3.9716782e-10 4.731950500000001e-10 3.1610486e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 5e-07 -2e-07 ] [ -5e-07 -8e-07 5e-07 ] [ 7e-07 -5e-07 -9e-07 ] [ 3e-07 7e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 8.010883169999999e-16 -3.204353268e-16 ] [ -8.010883169999999e-16 -1.2817413072e-15 8.010883169999999e-16 ] [ 1.1215236438e-15 -8.010883169999999e-16 -1.4419589706e-15 ] [ 4.806529901999999e-16 1.1215236438e-15 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }