{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1545.3574029 -202.5703587 -460.6848919 ] [ 1309.3763882 576.7969854 -1165.1595895 ] [ -1059.7395684 -34.3916983 3361.0904326 ] [ 111.1298485 -29.532859 -227.3094789 ] [ 1338.3714131 298.7597795 530.5159162 ] [ -153.7806784 -609.061849 -2038.4523885 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.475935522105303e-06 -3.245534954501386e-07 -7.380985694389959e-07 ] [ 2.097852254285353e-06 9.241306525695191e-07 -1.866791469177932e-06 ] [ -1.697889974615725e-06 -5.510157541983752e-08 5.385060555872671e-06 ] [ 1.780496466066599e-07 -4.731685662501661e-08 -3.64189935780296e-07 ] [ 2.144307405682381e-06 4.786659378938921e-07 8.49980204900742e-07 ] [ -2.463838096931485e-07 -9.758246631286362e-07 -3.26596078637619e-06 ] ] } "unrelaxed-potential-energy" { "source-value" 1182.6347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.8947896828976e-16 } "relaxed-configuration-positions" { "source-value" [ [ 0.4329135 -0.1930981 2.3810382 ] [ 0.3613887 1.5829345 -0.2503222 ] [ 0.153002 2.4693832 3.3739579 ] [ 2.2700247 -0.5741437 -0.0750548 ] [ 3.34548 1.0324112 2.0671316 ] [ 1.9103435 3.300447 1.308518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.329135e-11 -1.930981e-11 2.3810382e-10 ] [ 3.613887e-11 1.5829345e-10 -2.503222e-11 ] [ 1.53002e-11 2.4693832e-10 3.3739579e-10 ] [ 2.2700247e-10 -5.741437000000001e-11 -7.50548e-12 ] [ 3.34548e-10 1.0324112e-10 2.0671316e-10 ] [ 1.9103435e-10 3.300447e-10 1.308518e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -3.1e-06 -3.5e-06 ] [ 3.6e-06 -1.57e-05 -4.4e-06 ] [ -1.02e-05 1.65e-05 1.58e-05 ] [ -4.6e-06 1e-06 -1.56e-05 ] [ 8.8e-06 5.5e-06 3.9e-06 ] [ 4.7e-06 -4.2e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5247885948e-15 -4.9667475654e-15 -5.607618218999999e-15 ] [ 5.767835882399999e-15 -2.515417315379999e-14 -7.0495771896e-15 ] [ -1.63422016668e-14 2.6435914461e-14 2.53143908172e-14 ] [ -7.370012516399999e-15 1.602176634e-15 -2.49939554904e-14 ] [ 1.40991543792e-14 8.811971486999999e-15 6.248488872599999e-15 ] [ 7.530230179799999e-15 -6.729141862799999e-15 6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.337879 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.457399134891928e-18 } }