{ "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" [ [ 2.666012 2.519902 1.694639 ] [ 2.496155 4.523544 1.233674 ] [ 4.888558 1.942791 1.748689 ] [ 3.394286 2.23286 3.870587 ] [ 4.049493 3.873676 2.828862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.666012e-10 2.519902e-10 1.694639e-10 ] [ 2.496155e-10 4.523544000000001e-10 1.233674e-10 ] [ 4.888558e-10 1.942791e-10 1.748689e-10 ] [ 3.394286e-10 2.23286e-10 3.870587e-10 ] [ 4.049493e-10 3.873676e-10 2.828862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.421569 -75.953245 -11.1614027 ] [ -14.1462853 70.4370352 -23.7187608 ] [ 15.7925226 -9.0249038 -5.7593357 ] [ -21.869437 -62.8249959 56.5126591 ] [ 44.6447687 77.3661094 -15.87316 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.912766689505404e-08 -1.216905134128945e-07 -1.7882538461274e-08 ] [ -2.266484757882672e-08 1.128525710359066e-07 -3.800164402810751e-08 ] [ 2.530241049317563e-08 -1.445948987332908e-08 -9.227473009878802e-09 ] [ -3.503870067145849e-08 -1.006567396328358e-07 9.054326118926038e-08 ] [ 7.15288046521636e-08 1.239541717229351e-07 -2.543160585021773e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.070697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.57480950133607e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3619852 2.1057153 1.4790927 ] [ 2.4447475 4.65181 1.2920246 ] [ 4.97516 1.9267569 1.7907797 ] [ 3.2947676 2.1394953 3.9462028 ] [ 4.4178437 4.2689955 2.8683513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3619852e-10 2.1057153e-10 1.4790927e-10 ] [ 2.4447475e-10 4.651810000000001e-10 1.2920246e-10 ] [ 4.97516e-10 1.9267569e-10 1.7907797e-10 ] [ 3.2947676e-10 2.1394953e-10 3.9462028e-10 ] [ 4.4178437e-10 4.2689955e-10 2.8683513e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 -3.88e-05 -8.3e-06 ] [ 7.8e-06 1.14e-05 5.27e-05 ] [ 3.9e-05 -5.1e-05 -1.94e-05 ] [ -4.21e-05 9.2e-06 -8e-06 ] [ 3.3e-06 6.91e-05 -1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 -6.216445288704e-14 -1.329806595264e-14 ] [ 1.249697764224e-14 1.826481347712e-14 8.443470791616e-14 ] [ 6.248488821120001e-14 -8.17110076608e-14 -3.108222644352e-14 ] [ -6.745163573568001e-14 1.474002491136e-14 -1.28174129664e-14 ] [ 5.28718284864e-15 1.1071040449728e-13 -2.707678489152e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }