{ "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" [ [ 0.9925273 0.3379082 1.803379 ] [ 1.204741 2.296652 0.0005587 ] [ 2.970089 0.0748089 0.2894365 ] [ 2.914059 2.502311 2.040612 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.925273e-11 3.379082e-11 1.803379e-10 ] [ 1.204741e-10 2.296652e-10 5.587e-14 ] [ 2.970089000000001e-10 7.48089e-12 2.894365e-11 ] [ 2.914059e-10 2.502311e-10 2.040612e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.145653 4.4170609 -1.1651507 ] [ 4.1508908 -4.8675951 2.6693777 ] [ -4.1074319 5.5599337 1.1645769 ] [ -4.1891118 -5.1093995 -2.6688039 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.642068369272002e-09 7.07691176493501e-09 -1.866777226628744e-09 ] [ 6.650460250045566e-09 -7.798747132992892e-09 4.276814578260662e-09 ] [ -6.580831415926224e-09 8.907995860729165e-09 1.865857897676154e-09 ] [ -6.711697043173681e-09 -8.186160492671284e-09 -4.275895249308072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8036249 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.250278547528059e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0333903 0.517727 1.8539791 ] [ 1.2812794 2.1344109 0.0204744 ] [ 2.9485258 0.3552578 0.3233908 ] [ 2.8182208 2.2042844 1.9361419 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0333903e-10 5.177270000000001e-11 1.8539791e-10 ] [ 1.2812794e-10 2.1344109e-10 2.04744e-12 ] [ 2.9485258e-10 3.552578000000001e-11 3.233908e-11 ] [ 2.8182208e-10 2.2042844e-10 1.9361419e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.33e-05 -6.1e-06 1.07e-05 ] [ -1.1e-06 -1.3e-06 -9e-07 ] [ 1.52e-05 -1.09e-05 -2.09e-05 ] [ 9.2e-06 1.83e-05 1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.733071557219999e-14 -9.773277467399999e-15 1.71432899838e-14 ] [ -1.7623942974e-15 -2.0828296242e-15 -1.4419589706e-15 ] [ 2.43530848368e-14 -1.74637253106e-14 -3.34854916506e-14 ] [ 1.47400250328e-14 2.93198324022e-14 1.77841606374e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.513842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684503198596783e-18 } }