{ "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" [ [ 0.5178768 0.1602588 0.5935764 ] [ 0.4933098 1.000634 2.761993 ] [ 1.438085 2.624316 0.8145388 ] [ 2.471365 1.192312 0.8679319 ] [ 2.522268 2.85035 2.866422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.178768e-11 1.602588e-11 5.935764e-11 ] [ 4.933098e-11 1.000634e-10 2.761993e-10 ] [ 1.438085e-10 2.624316e-10 8.145388e-11 ] [ 2.471365e-10 1.192312e-10 8.679319e-11 ] [ 2.522268e-10 2.85035e-10 2.866422e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9459073 -3.2286177 -3.0170133 ] [ -0.4067605 1.6457615 4.1447436 ] [ -16.4341873 21.6234891 -3.3317557 ] [ 20.7496615 -19.4445807 -0.2742275 ] [ 0.0371936 -0.5960523 2.478253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.322040423904052e-09 -5.172815796441068e-09 -4.833788173902657e-09 ] [ -6.517021633649185e-10 2.636800598712739e-09 6.640611295130427e-09 ] [ -2.633047067390828e-08 3.464464869614363e-08 -5.338061088757139e-09 ] [ 3.324462254481386e-08 -3.11536525987989e-08 -4.39360889280432e-10 ] [ 5.959071636338688e-11 -9.549810598340679e-10 3.970599017027462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.4975879 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.399400320972969e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5666424 0.5607031 0.8964129 ] [ 0.3675384 0.8552887 3.27623 ] [ 1.3088146 2.9494749 0.3285694 ] [ 3.0732355 1.0718001 0.7086148 ] [ 2.1266737 2.390604 2.694635 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.666424e-11 5.607031e-11 8.964129e-11 ] [ 3.675384e-11 8.552887000000001e-11 3.27623e-10 ] [ 1.3088146e-10 2.9494749e-10 3.285694e-11 ] [ 3.0732355e-10 1.0718001e-10 7.086148e-11 ] [ 2.1266737e-10 2.390604e-10 2.694635e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.65e-05 3.77e-05 -2.83e-05 ] [ 1.98e-05 2.7e-05 4.16e-05 ] [ -7.4e-06 -9.8e-06 1.3e-05 ] [ -1.39e-05 -3e-06 1.37e-05 ] [ -4.49e-05 -5.2e-05 -4.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.45012128672e-14 6.040205860416e-14 -4.534159836864e-14 ] [ 3.172309709184e-14 4.32587687616e-14 6.665054742528e-14 ] [ -1.185610699392e-14 -1.570133088384e-14 2.08282960704e-14 ] [ -2.227025502912e-14 -4.8065298624e-15 2.194981970496e-14 ] [ -7.193773027392e-14 -8.33131842816e-14 -6.424728249408e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }