{ "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" [ [ 1.707964 2.049797 2.376981 ] [ 0.4160118 4.05664 2.341909 ] [ 2.458635 3.954401 1.032866 ] [ 3.928295 2.199643 0.7405181 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.707964e-10 2.049797e-10 2.376981e-10 ] [ 4.160118e-11 4.05664e-10 2.341909e-10 ] [ 2.458635e-10 3.954401e-10 1.032866e-10 ] [ 3.928295e-10 2.199643e-10 7.405181e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5228607 -0.4837453 -0.1612929 ] [ -0.0255017 -0.0623466 0.0377243 ] [ 0.2196193 0.7031423 -0.4445817 ] [ -0.7169783 -0.1570504 0.5681503 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.377151894751225e-10 -7.750454100818822e-10 -2.584197134810323e-10 ] [ -4.085822753065536e-11 -9.989026490636928e-11 6.044099149604544e-11 ] [ 3.518689079364615e-10 1.12655815415554e-09 -7.122984057755194e-10 ] [ -1.148725869880928e-09 -2.516224791672883e-10 9.102771277605062e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5066911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.822691738387436e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7443437 1.750282 2.4538598 ] [ 0.8264166 3.8049244 2.1933961 ] [ 2.51111 4.379959 0.7922784 ] [ 3.4290355 2.3253156 1.0527398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7443437e-10 1.750282e-10 2.4538598e-10 ] [ 8.264166e-11 3.8049244e-10 2.1933961e-10 ] [ 2.51111e-10 4.379959000000001e-10 7.922784000000001e-11 ] [ 3.4290355e-10 2.3253156e-10 1.0527398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 1.4e-06 -2.1e-06 ] [ -1.6e-06 2e-06 1e-06 ] [ -1.5e-06 -1.5e-06 9e-07 ] [ 1.9e-06 -1.9e-06 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.92261194496e-15 2.24304726912e-15 -3.36457090368e-15 ] [ -2.56348259328e-15 3.2043532416e-15 1.6021766208e-15 ] [ -2.4032649312e-15 -2.4032649312e-15 1.44195895872e-15 ] [ 3.04413557952e-15 -3.04413557952e-15 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }