{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6686859 -11.6694118 -3.4446912 ] [ -69.8396654 -30.1372457 79.5489196 ] [ -1.1007308 14.6608907 -2.5444286 ] [ 4.3204864 -17.7251901 -4.4004719 ] [ 8.5092971 -17.0791775 -1.2756371 ] [ 64.4966116 45.6822041 -79.3277976 ] [ 2.2826871 16.2679302 11.4441067 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.388876588203861e-08 -1.869645876444765e-08 -5.519003706515497e-09 ] [ -1.118954791083747e-07 -4.828519047584533e-08 1.274514191930189e-07 ] [ -1.763565153554481e-09 2.348933631964415e-08 -4.076624016214875e-09 ] [ 6.922182300564357e-09 -2.839888517745561e-08 -7.050333198667356e-09 ] [ 1.363339687306124e-08 -2.736385889299339e-08 -2.043795938245112e-09 ] [ 1.033349632263381e-07 7.31909593956339e-08 -1.270971426942743e-07 ] [ 3.657267904221752e-09 2.606409743524627e-08 1.833548020068064e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.7072624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.735335902850898e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2083225 1.495327 0.8689944 ] [ 2.8432201 3.7007495 4.1464284 ] [ 1.0379725 3.9682909 0.3523719 ] [ 3.3870291 1.9410156 2.0921707 ] [ 3.7336413 1.141675 4.5301522 ] [ 3.1326752 4.5098247 1.6803405 ] [ 4.7571273 3.1446063 5.833339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2083225e-10 1.495327e-10 8.689943999999999e-11 ] [ 2.8432201e-10 3.7007495e-10 4.1464284e-10 ] [ 1.0379725e-10 3.9682909e-10 3.523719000000001e-11 ] [ 3.3870291e-10 1.9410156e-10 2.0921707e-10 ] [ 3.7336413e-10 1.141675e-10 4.5301522e-10 ] [ 3.1326752e-10 4.5098247e-10 1.6803405e-10 ] [ 4.7571273e-10 3.1446063e-10 5.833339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.88e-05 5.35e-05 -1.63e-05 ] [ 4.49e-05 3.56e-05 1.9e-05 ] [ 3.25e-05 -0.0001091 -1.82e-05 ] [ -1.3e-05 6.36e-05 -2.16e-05 ] [ -1.98e-05 -2.67e-05 8.1e-06 ] [ -4.49e-05 6.8e-06 6.3e-06 ] [ 1.91e-05 -2.37e-05 2.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.012092047104e-14 8.57164492128e-14 -2.611547891904e-14 ] [ 7.193773027392e-14 5.703748770048e-14 3.04413557952e-14 ] [ 5.207074017599999e-14 -1.7479746932928e-13 -2.915961449856e-14 ] [ -2.08282960704e-14 1.0189843308288e-13 -3.460701500928e-14 ] [ -3.172309709184e-14 -4.277811577536e-14 1.297763062848e-14 ] [ -7.193773027392e-14 1.089480102144e-14 1.009371271104e-14 ] [ 3.060157345728e-14 -3.797158591296e-14 3.652962695424e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.576963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.777445890806663e-18 } }