{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -41.4088652 -20.9326813 -29.0650016 ] [ 17.5962301 -37.5534224 10.5188799 ] [ -24.864481 29.7246415 -29.9550458 ] [ -4.321443 -14.8794475 12.3438126 ] [ 15.733891 7.3878851 7.2628781 ] [ 23.2927634 22.6086759 -23.2113509 ] [ 13.9719047 13.6443487 52.1058276 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.634431626389573e-08 -3.353785286582874e-08 -4.65672664306926e-08 ] [ 2.819226871270748e-08 -6.01672158960122e-08 1.685310359163226e-08 ] [ -3.983729047473695e-08 4.762412606532671e-08 -4.799327445115983e-08 ] [ -6.923714999762862e-09 -2.383950311132971e-08 1.977696812219478e-08 ] [ 2.520847252210289e-08 1.183669688189675e-08 1.163641358741031e-08 ] [ 3.731912126077039e-08 3.622309225265892e-08 -3.718868405555486e-08 ] [ 2.238545924281478e-08 2.186065667328827e-08 8.348273947595227e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1378792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.823083466554613e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7116283 3.7820138 2.1231792 ] [ 4.5846969 0.7630718 2.0061401 ] [ 3.7341154 2.8646411 0.7365976 ] [ 4.2181225 1.4383046 4.4906769 ] [ 5.5434094 3.1781174 2.8522952 ] [ 4.0184386 5.2402231 2.0669829 ] [ 3.213532 3.8242372 4.2672675 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7116283e-10 3.7820138e-10 2.1231792e-10 ] [ 4.5846969e-10 7.630717999999999e-11 2.0061401e-10 ] [ 3.7341154e-10 2.8646411e-10 7.365976e-11 ] [ 4.2181225e-10 1.4383046e-10 4.490676900000001e-10 ] [ 5.5434094e-10 3.1781174e-10 2.8522952e-10 ] [ 4.0184386e-10 5.2402231e-10 2.0669829e-10 ] [ 3.213532e-10 3.8242372e-10 4.2672675e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.25e-05 -3.97e-05 -7.7e-06 ] [ -4.92e-05 7.17e-05 0.0001114 ] [ -3.16e-05 4.44e-05 1.69e-05 ] [ 6.11e-05 -4.36e-05 -7.82e-05 ] [ -4.3e-05 -2.11e-05 1.06e-05 ] [ 1.3e-05 -1.18e-05 -7.4e-06 ] [ -2.27e-05 1e-07 -4.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.16157805965e-13 -6.36064123698e-14 -1.23367600818e-14 ] [ -7.882709039280001e-14 1.148760646578e-13 1.784824770276e-13 ] [ -5.06287816344e-14 7.11366425496e-14 2.70767851146e-14 ] [ 9.789299233739998e-14 -6.985490124239999e-14 -1.252902127788e-13 ] [ -6.889359526199999e-14 -3.38059269774e-14 1.69830723204e-14 ] [ 2.082829624199999e-14 -1.89056842812e-14 -1.18561070916e-14 ] [ -3.636940959179999e-14 1.602176634e-16 -7.32194721738e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.67255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.95297831111967e-18 } }