{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1329364e-10 -1.034778e-11 1.505174e-10 ] [ 4.049425e-11 1.8165285e-10 4.713988e-11 ] [ 2.335993e-11 3.0778368e-10 2.4241414e-10 ] [ 2.6665421e-10 7.142872e-11 2.9821247e-10 ] [ 2.5204102e-10 2.7674543e-10 2.38158e-11 ] [ 2.5583384e-10 2.9717576e-10 2.5601013e-10 ] ] "source-value" [ [ 1.1329364 -0.1034778 1.505174 ] [ 0.4049425 1.8165285 0.4713988 ] [ 0.2335993 3.0778368 2.4241414 ] [ 2.6665421 0.7142872 2.9821247 ] [ 2.5204102 2.7674543 0.238158 ] [ 2.5583384 2.9717576 2.5601013 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.97860655572928e-12 -3.86412957404544e-12 -1.538089555968e-12 ] [ -5.70022398148224e-12 -8.15171442896832e-12 -4.19065316936448e-12 ] [ -8.347340194367999e-14 3.29695905028224e-12 3.748131986699521e-12 ] [ -8.1334496154912e-12 4.03620334311936e-12 2.2486548872928e-12 ] [ 1.02571347263616e-12 7.02378208792512e-12 -5.66193196024512e-12 ] [ 9.9126667528896e-12 -2.34094026065088e-12 5.3937275939232e-12 ] ] "source-value" [ [ 0.0018591 -0.0024118 -0.00096 ] [ -0.0035578 -0.0050879 -0.0026156 ] [ -5.21e-05 0.0020578 0.0023394 ] [ -0.0050765 0.0025192 0.0014035 ] [ 0.0006402 0.0043839 -0.0035339 ] [ 0.006187 -0.0014611 0.0033665 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.96183144607418e-18 "source-value" -18.486298 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.679756572114774e-08 -4.618563654814911e-08 -2.040818997953068e-08 ] [ -1.314347048854005e-08 -1.094041290700457e-08 -3.217945851702608e-08 ] [ -8.813277460715978e-08 7.590049801184266e-08 2.167494275366543e-08 ] [ 1.457390782667925e-07 -1.057676021432685e-07 5.398611589025216e-08 ] [ 4.690945316186922e-09 2.782743187536735e-09 -1.002147825765591e-08 ] [ -2.235621292634956e-08 8.42104103990428e-08 -1.305193188970492e-08 ] ] "source-value" [ [ -16.7257251 -28.8268072 -12.7377904 ] [ -8.2035091 -6.8284687 -20.0848384 ] [ -55.0081517 47.3733651 13.5284353 ] [ 90.9631787 -66.0149454 33.6954835 ] [ 2.9278578 1.7368517 -6.2549148 ] [ -13.9536507 52.5600045 -8.1463752 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.626193307719849e-18 "source-value" 41.357446 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "instance-id" 1 }