{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.7506815e-10 -5.240946e-11 1.4892015e-10 ] [ 1.5336372e-10 3.2136655e-10 8.532518e-11 ] [ -4.144114e-11 2.494492e-10 2.2725233e-10 ] [ 1.9068976e-10 1.1003833e-10 -3.961794e-11 ] [ 1.338052e-10 1.055716e-10 3.3598616e-10 ] [ 3.0725187e-10 2.7866433e-10 2.795672e-10 ] ] "source-value" [ [ 1.7506815 -0.5240946 1.4892015 ] [ 1.5336372 3.2136655 0.8532518 ] [ -0.4144114 2.494492 2.2725233 ] [ 1.9068976 1.1003833 -0.3961794 ] [ 1.338052 1.055716 3.3598616 ] [ 3.0725187 2.7866433 2.795672 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.97492154950144e-12 6.1980202575648e-12 -1.38596288582304e-11 ] [ -5.725057719104641e-12 6.0578298032448e-13 7.257860092224001e-14 ] [ 5.498349727261441e-12 2.39188947719232e-12 -6.946076521816319e-12 ] [ -5.46133944732096e-12 -1.00840996513152e-11 1.150859488486848e-11 ] [ -3.15292337207232e-12 -3.7346737030848e-12 5.190892033729919e-12 ] [ 5.86620947939712e-12 4.6230806393184e-12 4.033479642864e-12 ] ] "source-value" [ [ 0.0018568 0.0038685 -0.0086505 ] [ -0.0035733 0.0003781 4.53e-05 ] [ 0.0034318 0.0014929 -0.0043354 ] [ -0.0034087 -0.006294 0.0071831 ] [ -0.0019679 -0.002331 0.0032399 ] [ 0.0036614 0.0028855 0.0025175 ] ] } "species" { "source-value" [ "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" -3.097677918922205e-18 "source-value" -19.334185 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.215006034125895e-07 -6.518646064503246e-08 1.14514176713449e-07 ] [ 1.185332721748291e-09 4.215422819922049e-09 -1.518262059523783e-08 ] [ -2.228966833086421e-07 1.394122101642947e-07 -1.700786057650403e-08 ] [ 1.232239130774581e-07 6.975847735196338e-08 -1.101321618115435e-07 ] [ 1.859281942227037e-07 -1.806538863051708e-07 2.380507229955768e-08 ] [ 3.405984669932152e-08 3.245423661402314e-08 4.00339413049628e-09 ] ] "source-value" [ [ -75.8347125 -40.6861889 71.4741279 ] [ 0.7398265 2.63106 -9.4762465 ] [ -139.1211683 87.0142582 -10.6154717 ] [ 76.9103178 43.5398173 -68.7390893 ] [ 116.0472521 -112.755288 14.8579576 ] [ 21.2584844 20.2563414 2.4987221 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 8.037592189357047e-18 "source-value" 50.166705 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.250049e-10 6.506043e-13 1.072993e-10 ] [ 1.196915e-10 2.832702e-10 8.072165e-11 ] [ 1.797786e-11 2.271145e-10 2.71237e-10 ] [ 2.446401e-10 6.534775e-11 2.390438e-12 ] [ 1.500106e-10 1.367345e-10 2.855106e-10 ] [ 2.614126e-10 2.99563e-10 2.902741e-10 ] ] "source-value" [ [ 1.250049 0.006506043 1.072993 ] [ 1.196915 2.832702 0.8072165 ] [ 0.1797786 2.271145 2.71237 ] [ 2.446401 0.6534775 0.02390438 ] [ 1.500106 1.367345 2.855106 ] [ 2.614126 2.99563 2.902741 ] ] } "instance-id" 1 }