{ "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" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1208237 -2.7854602 -0.8346876 ] [ -11.2767972 3.1447561 3.0476683 ] [ 3.0601209 -3.0430252 0.3565385 ] [ 4.1300676 -16.9788984 4.5636581 ] [ 8.2074325 19.6626277 -7.1331773 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.602287390578553e-09 -4.462799210608892e-09 -1.337316958391662e-09 ] [ -1.80674208313429e-08 5.038454701538187e-09 4.882902898213281e-09 ] [ 4.902854162801455e-09 -4.875463831945244e-09 5.712376491151008e-10 ] [ 6.617097751043566e-09 -2.720319406341852e-08 7.311786313144548e-09 ] [ 1.314975646829409e-08 3.150300240443448e-08 -1.142860990208127e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1994804 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.473919242038783e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1287497 0.6118337 0.4761486 ] [ 0.7041557 1.7226169 2.446601 ] [ 2.2687251 0.8587229 0.5144382 ] [ 2.9745373 0.7230424 2.9393083 ] [ 2.7574379 3.0178776 1.7374516 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.287497e-11 6.118337000000001e-11 4.761486e-11 ] [ 7.041557e-11 1.7226169e-10 2.446601e-10 ] [ 2.2687251e-10 8.587229e-11 5.144382e-11 ] [ 2.9745373e-10 7.230424e-11 2.9393083e-10 ] [ 2.757437900000001e-10 3.0178776e-10 1.7374516e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 -2.63e-05 -5.9e-05 ] [ -5.21e-05 4.64e-05 6.99e-05 ] [ -1.2e-05 -3.19e-05 4e-06 ] [ 4.16e-05 -3.5e-05 -8.8e-06 ] [ 1.87e-05 4.69e-05 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 -4.213724512704e-14 -9.45284206272e-14 ] [ -8.347340194367999e-14 7.434099520512001e-14 1.1199214579392e-13 ] [ -1.92261194496e-14 -5.110943420352001e-14 6.4087064832e-15 ] [ 6.665054742528e-14 -5.6076181728e-14 -1.409915426304e-14 ] [ 2.996070280896e-14 7.514208351552e-14 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.808942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089389278319e-18 } }