{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.7112358 -6.8805332 -5.1504927 ] [ -9.5598541 -0.0149071 -18.0656705 ] [ -10.4730946 -3.5237787 12.931576 ] [ 12.2776673 0.092676 -2.4889422 ] [ 4.6761763 -3.0295818 5.8959892 ] [ 2.498358 -0.5310094 -3.030498 ] [ 14.2919829 13.8871343 9.9080381 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.19678216220243e-08 -1.102382952250125e-08 -8.25199905752757e-09 ] [ -1.53165748634691e-08 -2.38838073007014e-11 -2.894439515264309e-08 ] [ -1.677974745379158e-08 -5.645715896526895e-09 2.071866890799518e-08 ] [ 1.967099166808586e-08 1.48483321732584e-10 -3.987725036216555e-09 ] [ 7.492060404324574e-09 -4.85392517075166e-09 9.446416130556352e-09 ] [ 4.002810810966971e-09 -8.507708531143594e-10 -4.855393084983731e-09 ] [ 2.289828105590756e-08 2.224964208867994e-08 1.587442713260175e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6407323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.037449489709077e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0642193 1.0723348 1.9680831 ] [ 1.5242799 3.5051476 2.4011978 ] [ 1.3788009 3.2561207 4.8776376 ] [ 4.2996116 1.8408073 2.8691122 ] [ 3.8124681 2.7636853 5.1027684 ] [ 3.8877425 4.1589336 2.1465773 ] [ 4.5686507 5.0741567 4.4044736 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0642193e-10 1.0723348e-10 1.9680831e-10 ] [ 1.5242799e-10 3.5051476e-10 2.4011978e-10 ] [ 1.3788009e-10 3.2561207e-10 4.8776376e-10 ] [ 4.299611600000001e-10 1.8408073e-10 2.8691122e-10 ] [ 3.8124681e-10 2.7636853e-10 5.102768400000001e-10 ] [ 3.8877425e-10 4.1589336e-10 2.1465773e-10 ] [ 4.5686507e-10 5.074156699999999e-10 4.4044736e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -7.9e-06 5.5e-06 ] [ -2.71e-05 -1.48e-05 -2.6e-06 ] [ 1.62e-05 1.48e-05 -3.21e-05 ] [ 1.7e-06 1.28e-05 -5.6e-06 ] [ 5.4e-06 3e-07 -1e-06 ] [ -2.1e-06 2e-06 3.12e-05 ] [ 9.9e-06 -7.1e-06 4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.248488872599999e-15 -1.26571954086e-14 8.811971486999999e-15 ] [ -4.34189867814e-14 -2.37122141832e-14 -4.165659248399999e-15 ] [ 2.59552614708e-14 2.37122141832e-14 -5.14298699514e-14 ] [ 2.7237002778e-15 2.05078609152e-14 -8.972189150399999e-15 ] [ 8.6517538236e-15 4.806529901999999e-16 -1.602176634e-15 ] [ -3.364570931399999e-15 3.204353268e-15 4.998791098079999e-14 ] [ 1.58615486766e-14 -1.13754541014e-14 7.209794853e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }