{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1822802 0.0076746 0.1964777 ] [ -4.1263758 -3.8081571 4.2531576 ] [ 0.4146521 -0.2972287 0.0158333 ] [ 0.1168577 0.4891376 -0.0862216 ] [ 3.7771462 3.6085737 -4.3792471 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.920450748747482e-10 1.229606469399168e-11 3.147919774485562e-10 ] [ -6.611182835394897e-09 -6.101340273953527e-09 6.814309671297838e-09 ] [ 6.643459003856237e-10 -4.76212874170777e-10 2.536774309011264e-11 ] [ 1.872266749004602e-10 7.836848270742221e-10 -1.381422317279693e-10 ] [ 6.051655334983561e-09 5.781572416573753e-09 -7.016327320326199e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.955842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.915537053437871e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8654271 2.664839 1.697836 ] [ 2.2796092 2.547423 5.0647118 ] [ 0.4991444 1.9936417 3.5534648 ] [ 1.4743614 4.1787943 3.5097016 ] [ 3.6458921 3.218619 3.2090818 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8654271e-10 2.664839e-10 1.697836e-10 ] [ 2.2796092e-10 2.547423000000001e-10 5.064711800000001e-10 ] [ 4.991444e-11 1.9936417e-10 3.5534648e-10 ] [ 1.4743614e-10 4.1787943e-10 3.5097016e-10 ] [ 3.6458921e-10 3.218619e-10 3.2090818e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 1e-07 -1.32e-05 ] [ -1e-07 1.1e-06 6.4e-06 ] [ -6.4e-06 -0.0 3.4e-06 ] [ 2e-06 -5.7e-06 1.3e-06 ] [ 6.3e-06 4.5e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 1.6021766208e-16 -2.114873139456e-14 ] [ -1.6021766208e-16 1.76239428288e-15 1.025393037312e-14 ] [ -1.025393037312e-14 0.0 5.44740051072e-15 ] [ 3.2043532416e-15 -9.13240673856e-15 2.08282960704e-15 ] [ 1.009371271104e-14 7.2097947936e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }