{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.715262 0.8700472 -0.786719 ] [ 0.6348034 -0.2147693 0.6443813 ] [ -0.0345278 -0.7840672 3.0054314 ] [ 1.0677262 0.8562919 -2.140032 ] [ -0.9527398 -0.7275027 -0.7230616 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.14597605414665e-09 1.393969282832502e-09 -1.260462788939155e-09 ] [ 1.017067166284351e-09 -3.440983513255815e-10 1.032412653740711e-09 ] [ -5.531963392765823e-11 -1.256214136976118e-09 4.815231924498213e-09 ] [ 1.710685955055625e-09 1.371930862760412e-09 -3.428709238163866e-09 ] [ -1.526457433265668e-09 -1.165587817508876e-09 -1.158472390918241e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.724095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.198842415063818e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4619886 2.7013715 3.1238303 ] [ 2.7130212 4.608246 1.5740819 ] [ 4.3799235 2.7898799 1.4480316 ] [ 4.7401719 1.986112 3.7556467 ] [ 4.3378777 4.4002857 3.4227306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4619886e-10 2.7013715e-10 3.1238303e-10 ] [ 2.7130212e-10 4.608246e-10 1.5740819e-10 ] [ 4.3799235e-10 2.7898799e-10 1.4480316e-10 ] [ 4.7401719e-10 1.986112e-10 3.7556467e-10 ] [ 4.3378777e-10 4.400285700000001e-10 3.4227306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 1.7e-06 -5e-07 ] [ -3.3e-06 4.6e-06 -3.1e-06 ] [ 1e-07 2e-07 4e-06 ] [ 3.6e-06 -2.8e-06 1.7e-06 ] [ -1.7e-06 -3.7e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 2.72370025536e-15 -8.010883104e-16 ] [ -5.28718284864e-15 7.370012455680001e-15 -4.96674752448e-15 ] [ 1.6021766208e-16 3.2043532416e-16 6.4087064832e-15 ] [ 5.76783583488e-15 -4.48609453824e-15 2.72370025536e-15 ] [ -2.72370025536e-15 -5.928053496960001e-15 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.299971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2911079214318e-18 } }