{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7699977 0.2576193 1.27547 ] [ 0.6265566 2.494782 0.6353127 ] [ 2.748297 1.297333 0.3747024 ] [ 2.66914 2.750152 1.670621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.699977e-11 2.576193e-11 1.27547e-10 ] [ 6.265566000000001e-11 2.494782e-10 6.353127e-11 ] [ 2.748297e-10 1.297333e-10 3.747024e-11 ] [ 2.66914e-10 2.750152e-10 1.670621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.001291 -6.7795408 2.243167 ] [ -19.9170533 11.3473617 -1.7743096 ] [ 18.0089285 -10.1257875 -6.3264471 ] [ 5.9094159 5.5579666 5.8575897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.410774893217454e-09 -1.086202176951973e-08 3.593949723950074e-09 ] [ -3.191063715248748e-08 1.818047762350134e-08 -2.842757359180999e-09 ] [ 2.885348420835881e-08 -1.622329999968888e-08 -1.013608563634796e-08 ] [ 9.46792799756379e-09 8.904844145707265e-09 9.384893271578885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.481606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198685421923701e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5878808 0.0966659 0.6704618 ] [ 0.587063 2.4363442 1.1926875 ] [ 2.8199333 0.9636023 0.7853469 ] [ 2.8191142 3.3032739 1.3076099 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.878808e-11 9.66659e-12 6.704618e-11 ] [ 5.87063e-11 2.4363442e-10 1.1926875e-10 ] [ 2.8199333e-10 9.636023000000001e-11 7.853468999999999e-11 ] [ 2.8191142e-10 3.3032739e-10 1.3076099e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.59e-05 -1.34e-05 -8.9e-06 ] [ -4.9e-05 5.35e-05 1.9e-05 ] [ 3.46e-05 -4.97e-05 -7e-06 ] [ -1.5e-06 9.6e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.547460827072e-14 -2.146916671872e-14 -1.425937192512e-14 ] [ -7.85066544192e-14 8.57164492128e-14 3.04413557952e-14 ] [ 5.543531107968001e-14 -7.962817805376001e-14 -1.12152363456e-14 ] [ -2.4032649312e-15 1.538089555968e-14 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455470481064e-18 } }