{ "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" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5722382 2.9808328 -4.3381863 ] [ 0.7600003 -0.1007922 -0.519562 ] [ 14.0231185 -5.7641293 -20.8802262 ] [ -8.7646302 -11.2688892 24.9034541 ] [ 2.5537497 14.1529779 0.8345204 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.373423974512222e-08 4.775820662020795e-09 -6.950540723798914e-09 ] [ 1.21765472249299e-09 -1.614869077294548e-10 -8.324300963143079e-10 ] [ 2.246751279651313e-08 -9.235153279814775e-09 -3.345381053027461e-08 ] [ -1.404248571209074e-08 -1.805475096737495e-08 3.98997322649115e-08 ] [ 4.09155809842451e-09 2.267557049289838e-08 1.337049085476334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4748397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.56730697423557e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7448414 0.7873212 0.0936798 ] [ 0.9341428 3.1501561 2.9866028 ] [ 3.1341361 0.2250869 -0.047194 ] [ 1.874094 -0.3298605 1.9897173 ] [ 2.3520801 2.0670886 1.5039301 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.448414e-11 7.873212e-11 9.36798e-12 ] [ 9.341428e-11 3.1501561e-10 2.9866028e-10 ] [ 3.1341361e-10 2.250869e-11 -4.7194e-12 ] [ 1.874094e-10 -3.298605e-11 1.9897173e-10 ] [ 2.3520801e-10 2.0670886e-10 1.5039301e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 -9.6e-06 -9e-07 ] [ 5.2e-06 1.38e-05 4.3e-06 ] [ 5.9e-06 9.7e-06 1.5e-06 ] [ -4.6e-06 -9.7e-06 -4.7e-06 ] [ -4.8e-06 -4.2e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.7237002778e-15 -1.53808956864e-14 -1.4419589706e-15 ] [ 8.331318496799998e-15 2.21100375492e-14 6.8893595262e-15 ] [ 9.452842140600001e-15 1.55411133498e-14 2.403264951e-15 ] [ -7.370012516399999e-15 -1.55411133498e-14 -7.530230179799999e-15 ] [ -7.690447843199998e-15 -6.729141862799999e-15 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.054986 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.931421689239712e-18 } }