{ "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" [ [ -7.6056555 -13.0032009 -5.5578571 ] [ -4.3350003 -2.9282454 -11.5698988 ] [ -24.1098275 20.8817351 7.1487574 ] [ 40.9885081 -29.1957706 14.7065183 ] [ 0.9141098 0.4252606 -3.4011532 ] [ -5.8521345 23.8202212 -1.3263666 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.218560342795894e-08 -2.083342447754552e-08 -8.904668707367287e-09 ] [ -6.945436131820987e-09 -4.691566319845145e-09 -1.853702136238198e-08 ] [ -3.862820195202092e-08 3.345622777895875e-08 1.145357197405099e-08 ] [ 6.567082939929142e-08 -4.677678108155998e-08 2.356243979362736e-08 ] [ 1.464565350404164e-09 6.813425910673804e-10 -5.449248140799107e-09 ] [ -9.376153077677097e-09 3.816420150892452e-08 -2.125073557129985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.4070498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.060872156261317e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2961848 0.2740402 1.7528463 ] [ 0.3890313 2.0698108 0.5511995 ] [ -0.1894523 3.5611806 2.1834401 ] [ 3.5038465 0.7691163 2.2937185 ] [ 2.7317106 2.1261572 0.569296 ] [ 1.785448 2.4440815 2.8305978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2961848e-10 2.740402e-11 1.7528463e-10 ] [ 3.890313000000001e-11 2.0698108e-10 5.511995e-11 ] [ -1.894523e-11 3.561180600000001e-10 2.1834401e-10 ] [ 3.5038465e-10 7.691163e-11 2.2937185e-10 ] [ 2.7317106e-10 2.1261572e-10 5.692960000000001e-11 ] [ 1.785448e-10 2.4440815e-10 2.8305978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.05e-05 1.61e-05 3.17e-05 ] [ -3.18e-05 -4.81e-05 -4.71e-05 ] [ 3.8e-06 3.02e-05 -1e-07 ] [ -6.6e-05 -1.53e-05 -2.5e-05 ] [ 1.05e-05 4.29e-05 2.11e-05 ] [ 3.3e-05 -2.59e-05 1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.090991935040001e-14 2.579504359488e-14 5.078899887936e-14 ] [ -5.094921654144e-14 -7.706469546047999e-14 -7.546251883968001e-14 ] [ 6.08827115904e-15 4.838573394816e-14 -1.6021766208e-16 ] [ -1.057436569728e-13 -2.451330229824e-14 -4.005441552e-14 ] [ 1.68228545184e-14 6.873337703232e-14 3.380592669888e-14 ] [ 5.28718284864e-14 -4.149637447872e-14 3.108222644352e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.895749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.988738700510498e-18 } }