{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8639871 -18.927162 -3.4591432 ] [ -7.4894323 -0.6344656 -7.9922758 ] [ -32.9926489 25.2192468 4.6155891 ] [ 49.6929273 -38.9041285 18.5880607 ] [ 9.1333466 3.8527775 -8.5188566 ] [ -10.4802056 29.3937319 -3.2333742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.259949627789279e-08 -3.032465645449417e-08 -5.542158363039299e-09 ] [ -1.199939333412437e-08 -1.016525951021844e-09 -1.280503743374562e-08 ] [ -5.286005072584284e-08 4.040568761714522e-08 7.394988947239314e-09 ] [ 7.961684633917407e-08 -6.233128513529897e-08 2.978135627955128e-08 ] [ 1.463323439218317e-08 6.172830035644273e-09 -1.364871288046778e-08 ] [ -1.679114039349724e-08 4.709395004824316e-08 -5.180436549537904e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 17.707269 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.83701724100166e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1041616 -0.2239949 1.520282 ] [ 0.3630754 1.769017 0.4698183 ] [ 0.1807935 3.2227618 2.4349613 ] [ 2.7329576 0.6379189 3.0466755 ] [ 2.5221801 2.8787905 0.1306094 ] [ 2.6136008 2.9598933 2.5787517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1041616e-10 -2.239949e-11 1.520282e-10 ] [ 3.630754e-11 1.769017e-10 4.698183000000001e-11 ] [ 1.807935e-11 3.2227618e-10 2.4349613e-10 ] [ 2.7329576e-10 6.379189e-11 3.0466755e-10 ] [ 2.5221801e-10 2.8787905e-10 1.306094e-11 ] [ 2.6136008e-10 2.9598933e-10 2.5787517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.46e-05 -4.4e-06 -2.6e-06 ] [ 6.91e-05 4.73e-05 4.28e-05 ] [ -2.44e-05 -1.44e-05 -3.85e-05 ] [ 5.2e-05 -1.52e-05 2.6e-06 ] [ -2.92e-05 -1.66e-05 8.4e-06 ] [ -2.29e-05 3.2e-06 -1.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.145707728768e-14 -7.04957713152e-15 -4.16565921408e-15 ] [ 1.1071040449728e-13 7.578295416384e-14 6.857315937023999e-14 ] [ -3.909310954752e-14 -2.307134333952e-14 -6.16837999008e-14 ] [ 8.33131842816e-14 -2.435308463616e-14 4.16565921408e-15 ] [ -4.678355732736e-14 -2.659613190528e-14 1.345828361472e-14 ] [ -3.668984461632e-14 5.126965186560001e-15 -2.034764308416e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }