{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9648814 -16.332915 -15.7199202 ] [ -12.7504406 -2.5583722 18.0257984 ] [ -12.0178223 2.2974023 -9.4629239 ] [ 9.1955979 -8.9141866 -24.6783931 ] [ 15.1948345 -22.0096862 19.1889815 ] [ -7.9738313 35.1112229 -0.5848591 ] [ 15.3165431 12.4065349 13.2313163 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.115897014572477e-08 -2.616821456251363e-08 -2.518608862528166e-08 ] [ -2.042845783421912e-08 -4.098964126144661e-09 2.888051276773405e-08 ] [ -1.925467392198889e-08 3.680844253632148e-09 -1.516127543698956e-08 ] [ 1.473297196965758e-08 -1.428210136396864e-08 -3.953914446373204e-08 ] [ 2.434480859282526e-08 -3.52634046607844e-08 3.074413753626372e-08 ] [ -1.277548608706327e-08 5.625438045807759e-08 -9.370475764821292e-10 ] [ 2.453980726629556e-08 1.987746016191927e-08 2.119890563826996e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.353981 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.459978939440741e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5526925 1.8534629 0.7069158 ] [ 2.0524944 1.9455042 4.3291625 ] [ 1.5004939 3.1576341 2.3759334 ] [ 4.4983664 1.0231848 1.770571 ] [ 4.3865242 1.9260752 3.9536638 ] [ 2.884636 5.0617651 2.6040924 ] [ 4.8303006 4.2314906 3.6677621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5526925e-10 1.8534629e-10 7.069158e-11 ] [ 2.0524944e-10 1.9455042e-10 4.3291625e-10 ] [ 1.5004939e-10 3.1576341e-10 2.3759334e-10 ] [ 4.4983664e-10 1.0231848e-10 1.770571e-10 ] [ 4.386524200000001e-10 1.9260752e-10 3.953663800000001e-10 ] [ 2.884636e-10 5.0617651e-10 2.6040924e-10 ] [ 4.8303006e-10 4.2314906e-10 3.6677621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 -1.85e-05 -2.9e-05 ] [ -1.1e-06 7e-06 2.25e-05 ] [ -1.58e-05 2.25e-05 -1.5e-06 ] [ 6.8e-06 4.7e-06 -1.25e-05 ] [ 9.9e-06 -1.41e-05 2.4e-05 ] [ -2.59e-05 1.34e-05 -7e-07 ] [ 1.47e-05 -1.49e-05 -2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.826481347712e-14 -2.96402674848e-14 -4.64631220032e-14 ] [ -1.76239428288e-15 1.12152363456e-14 3.604897396800001e-14 ] [ -2.531439060864e-14 3.604897396800001e-14 -2.4032649312e-15 ] [ 1.089480102144e-14 7.53023011776e-15 -2.002720776e-14 ] [ 1.586154854592e-14 -2.259069035328e-14 3.84522388992e-14 ] [ -4.149637447872e-14 2.146916671872e-14 -1.12152363456e-15 ] [ 2.355199632576e-14 -2.387243164992e-14 -4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }