{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.4820425e-10 -1.9286785e-10 4.1547543e-10 ] [ -1.0160654e-10 2.2790121e-10 4.710247800000001e-10 ] [ 8.134136e-11 7.2205143e-10 3.1340015e-10 ] [ 2.7381305e-10 1.9356088e-10 2.492405e-11 ] [ 3.8168728e-10 2.4688477e-10 7.3335995e-10 ] [ 5.3327642e-10 6.780319200000001e-10 3.05047e-12 ] [ 7.607326800000001e-10 3.070351e-10 3.3939737e-10 ] ] "source-value" [ [ 2.4820425 -1.9286785 4.1547543 ] [ -1.0160654 2.2790121 4.7102478 ] [ 0.8134136 7.2205143 3.1340015 ] [ 2.7381305 1.9356088 0.2492405 ] [ 3.8168728 2.4688477 7.3335995 ] [ 5.3327642 6.7803192 0.0305047 ] [ 7.6073268 3.070351 3.3939737 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.2043532416e-16 -4.8065298624e-16 0.0 ] [ -6.408706483200001e-16 -1.6021766208e-16 3.2043532416e-16 ] [ -1.6021766208e-16 6.408706483200001e-16 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 3.2043532416e-16 0.0 -3.2043532416e-16 ] [ 0.0 0.0 0.0 ] ] "source-value" [ [ 2e-07 -3e-07 -0.0 ] [ -4e-07 -1e-07 2e-07 ] [ -1e-07 4e-07 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 2e-07 -0.0 -2e-07 ] [ 0.0 0.0 -0.0 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.261282201437089e-32 "source-value" 3.907985e-13 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.200056343951955e-09 -2.405014892592303e-08 -6.053619283085338e-10 ] [ -2.535887536295184e-08 2.223088954954694e-10 8.72687276449218e-09 ] [ -1.639854031063615e-08 2.002033586425573e-08 1.501129424155751e-09 ] [ -2.817346357322126e-09 -1.368090269160926e-08 -2.116335670362531e-08 ] [ 8.360885956826216e-09 -2.10797608953878e-09 2.522175243599002e-08 ] [ 1.310850891184459e-08 1.843174506032946e-08 -1.740836403641786e-08 ] [ 2.730542350619127e-08 1.164637886990404e-09 3.727327883496094e-09 ] ] "source-value" [ [ -2.621469 -15.0109224 -0.3778372 ] [ -15.8277652 0.1387543 5.4468856 ] [ -10.2351639 12.4957109 0.9369313 ] [ -1.7584493 -8.5389479 -13.2091284 ] [ 5.2184546 -1.3156952 15.7421798 ] [ 8.1816878 11.5041905 -10.8654463 ] [ 17.042705 0.7269098 2.3264151 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.246605483237025e-17 "source-value" 77.806995 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] "source-value" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] } "instance-id" 1 }