{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -23.7883221 18.21362 12.7269522 ] [ 28.9611343 -10.4491369 -21.7834754 ] [ -8.7572692 -26.3610115 -14.4558217 ] [ 7.7770194 -6.1496426 9.8266198 ] [ -12.5197109 -20.1653684 25.9387878 ] [ -9.2616698 10.6218425 -20.478918 ] [ 17.5888183 34.2896969 8.2258554 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.811309351667995e-08 2.918143614413529e-08 2.039082526887912e-08 ] [ 4.640085228730898e-08 -1.674136284871859e-08 -3.490097500565192e-08 ] [ -1.403069197429192e-08 -4.223499632593995e-08 -2.316077956219331e-08 ] [ 1.246015866218805e-08 -9.852813599995728e-09 1.574398050505037e-08 ] [ -2.005878810315492e-08 -3.23084818002991e-08 4.155851938505227e-08 ] [ -1.483883082312941e-08 1.701806772331982e-08 -3.281084363888029e-08 ] [ 2.81803934677592e-08 5.493815070749824e-08 1.317927320796143e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.854091 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.05945240818357e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6957815 4.2249935 3.4503195 ] [ 5.8795716 1.6731065 1.7964149 ] [ 3.4876281 1.3855196 1.5707468 ] [ 5.6737254 2.4985561 4.0616462 ] [ 3.23705 1.8296392 4.0456286 ] [ 2.5832757 3.5840991 1.1197366 ] [ 5.0030737 4.816124 3.8769168 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6957815e-10 4.2249935e-10 3.4503195e-10 ] [ 5.879571600000001e-10 1.6731065e-10 1.7964149e-10 ] [ 3.4876281e-10 1.3855196e-10 1.5707468e-10 ] [ 5.6737254e-10 2.4985561e-10 4.0616462e-10 ] [ 3.23705e-10 1.8296392e-10 4.0456286e-10 ] [ 2.5832757e-10 3.5840991e-10 1.1197366e-10 ] [ 5.0030737e-10 4.816124000000001e-10 3.8769168e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.8e-06 7.8e-06 1.1e-05 ] [ -4e-07 -8.6e-06 -2.05e-05 ] [ 1.3e-05 -2.25e-05 -1.58e-05 ] [ -1.25e-05 7.3e-06 4.6e-06 ] [ -1.3e-06 1e-07 2.31e-05 ] [ 5.6e-06 1.04e-05 -5.7e-06 ] [ 4.4e-06 5.4e-06 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.409915426304e-14 1.249697764224e-14 1.76239428288e-14 ] [ -6.408706483200001e-16 -1.377871893888e-14 -3.28446207264e-14 ] [ 2.08282960704e-14 -3.604897396800001e-14 -2.531439060864e-14 ] [ -2.002720776e-14 1.169588933184e-14 7.370012455680001e-15 ] [ -2.08282960704e-15 1.6021766208e-16 3.701027994048e-14 ] [ 8.972189076479999e-15 1.666263685632e-14 -9.13240673856e-15 ] [ 7.04957713152e-15 8.65175375232e-15 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.457688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.797029956682071e-18 } }