{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2861337 -1.1532018 -1.5363687 ] [ 1.2776127 0.0680161 1.7031039 ] [ 1.6373985 -2.2949121 -1.1313089 ] [ -2.1576306 0.7429039 -3.2764222 ] [ 1.1904619 1.5777133 -1.1245135 ] [ -1.5153804 0.7306621 2.1767669 ] [ 2.8536716 0.3288184 3.1887425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.264966586963001e-09 -1.847632963024477e-09 -2.461534012068889e-09 ] [ 2.046961198377164e-09 1.089738052579949e-10 2.728673251373301e-09 ] [ 2.623401595632989e-09 -3.676854513411032e-09 -1.812556670482965e-09 ] [ -3.456905303642677e-09 1.190263260081141e-09 -5.249407048710101e-09 ] [ 1.907330224133148e-09 2.527775363585217e-09 -1.801669239473981e-09 ] [ -2.427907048498553e-09 1.170649734324632e-09 3.487565036111292e-09 ] [ 4.57208592096093e-09 5.268251529688627e-10 5.108928683251345e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.000132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.165680362811395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4096228 2.7279045 1.5590206 ] [ 1.2762938 2.0393845 3.5754475 ] [ 2.7888576 3.3591653 4.9236526 ] [ 1.581718 4.3905953 3.0998924 ] [ 4.7889729 2.3974709 1.4530281 ] [ 3.6564459 1.6625701 3.4427462 ] [ 3.971902 4.0910983 2.9515725 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4096228e-10 2.7279045e-10 1.5590206e-10 ] [ 1.2762938e-10 2.0393845e-10 3.5754475e-10 ] [ 2.7888576e-10 3.3591653e-10 4.9236526e-10 ] [ 1.581718e-10 4.390595300000001e-10 3.0998924e-10 ] [ 4.7889729e-10 2.3974709e-10 1.4530281e-10 ] [ 3.6564459e-10 1.6625701e-10 3.4427462e-10 ] [ 3.971902e-10 4.0910983e-10 2.9515725e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.38e-05 1.02e-05 -6.64e-05 ] [ 5.11e-05 2.32e-05 -9.8e-06 ] [ -5.17e-05 5.05e-05 3.31e-05 ] [ -4.3e-06 -2.12e-05 6.72e-05 ] [ -7.99e-05 1e-06 5.95e-05 ] [ 3.65e-05 2.6e-05 -4.21e-05 ] [ -5.5e-06 -8.97e-05 -4.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.619710219904001e-14 1.634220153216e-14 -1.0638452762112e-13 ] [ 8.187122532288001e-14 3.717049760256e-14 -1.570133088384e-14 ] [ -8.283253129536002e-14 8.090991935040001e-14 5.303204614848e-14 ] [ -6.889359469440001e-15 -3.396614436096001e-14 1.0766626891776e-13 ] [ -1.2801391200192e-13 1.6021766208e-15 9.532950893760001e-14 ] [ 5.84794466592e-14 4.16565921408e-14 -6.745163573568001e-14 ] [ -8.8119714144e-15 -1.4371524288576e-13 -6.64903297632e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973336424062e-18 } }