{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2516538 0.1545805 -0.3697548 ] [ 0.9016065 -0.854205 0.7444402 ] [ -0.3423012 0.2535792 0.95369 ] [ -0.0933582 1.0254079 -0.8860563 ] [ -0.2142934 -0.5793626 -0.4423191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.03193834895479e-10 2.476652631315744e-10 -5.924124959885799e-10 ] [ 1.444532855461315e-09 -1.368587280370464e-09 1.192724684023676e-09 ] [ -5.48426979911785e-10 4.062786657611674e-10 1.527979821490752e-09 ] [ -1.495763253999706e-10 1.642884564163624e-09 -1.419618688572551e-09 ] [ -3.433358754717428e-10 -9.282412126859021e-10 -7.086733209532973e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.788425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.209149217265424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3386422 2.3090494 2.7718666 ] [ 2.7126778 4.5257323 2.050947 ] [ 4.3528662 2.8055975 1.4782836 ] [ 4.4273816 2.3144166 3.8720709 ] [ 4.8014152 4.5310991 3.1511529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3386422e-10 2.3090494e-10 2.7718666e-10 ] [ 2.7126778e-10 4.5257323e-10 2.050947e-10 ] [ 4.3528662e-10 2.8055975e-10 1.4782836e-10 ] [ 4.4273816e-10 2.3144166e-10 3.8720709e-10 ] [ 4.8014152e-10 4.5310991e-10 3.1511529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 5.7e-06 3.4e-06 ] [ 2.4e-06 -6.1e-06 5.8e-06 ] [ 5.4e-06 1.2e-06 -2.2e-06 ] [ -6.6e-06 5.6e-06 -4.8e-06 ] [ -5.3e-06 -6.3e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924145279999e-15 9.13240673856e-15 5.44740051072e-15 ] [ 3.84522388992e-15 -9.77327738688e-15 9.292624400640001e-15 ] [ 8.65175375232e-15 1.92261194496e-15 -3.52478856576e-15 ] [ -1.057436569728e-14 8.972189076479999e-15 -7.69044777984e-15 ] [ -8.491536090240001e-15 -1.009371271104e-14 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }