{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.5728207 -11.2496117 -21.1009781 ] [ 3.177112 -2.8368816 2.5092709 ] [ 36.8038161 -14.1318267 0.1513904 ] [ -28.3225891 24.7614431 22.037633 ] [ 4.9144818 3.4568768 -3.5973162 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.655258586625029e-08 -1.802386485881815e-08 -3.38074937878328e-08 ] [ 5.090294568063131e-09 -4.545185375497697e-09 4.020295171233775e-09 ] [ 5.896621371164263e-08 -2.264168234793721e-08 2.425541594935604e-10 ] [ -4.537779009654491e-08 3.967220523208948e-08 3.530818037037057e-08 ] [ 7.873867843307101e-09 5.538527189945917e-09 -5.763535913265096e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4229761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.688565522577164e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1573067 0.2806372 1.3553011 ] [ 0.9528523 2.6053455 1.2276158 ] [ 3.1517463 0.5216406 2.5496647 ] [ 1.2190805 1.5666023 3.2793883 ] [ 2.9472947 2.8463494 2.4219751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1573067e-10 2.806372e-11 1.3553011e-10 ] [ 9.528523e-11 2.6053455e-10 1.2276158e-10 ] [ 3.1517463e-10 5.216406e-11 2.5496647e-10 ] [ 1.2190805e-10 1.5666023e-10 3.2793883e-10 ] [ 2.9472947e-10 2.8463494e-10 2.4219751e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-06 -1.2e-05 -6e-06 ] [ 8e-07 7.3e-06 -1.3e-06 ] [ -2.8e-06 1.9e-06 2.1e-06 ] [ 2e-06 -1.6e-06 6.3e-06 ] [ 2.4e-06 4.3e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.84522388992e-15 -1.92261194496e-14 -9.6130597248e-15 ] [ 1.28174129664e-15 1.169588933184e-14 -2.08282960704e-15 ] [ -4.48609453824e-15 3.04413557952e-15 3.36457090368e-15 ] [ 3.2043532416e-15 -2.56348259328e-15 1.009371271104e-14 ] [ 3.84522388992e-15 6.889359469440001e-15 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.132621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.225601468162712e-18 } }