{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5821731 0.4659756 0.2570336 ] [ 0.1439969 -0.8911496 -0.5715691 ] [ -3.4502359 0.3044106 1.737465 ] [ -5.4470478 2.4854793 -2.2008973 ] [ 2.3324032 -1.6684096 1.766703 ] [ 2.1240425 -4.5616956 -6.0372501 ] [ 3.7146681 3.8653892 5.0485149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.327441300786606e-10 7.465752121832525e-10 4.118132246800589e-10 ] [ 2.307084666476755e-10 -1.427779054755272e-09 -9.157546491916974e-10 ] [ -5.527887295224847e-09 4.877195464437004e-10 2.783725802458272e-09 ] [ -8.727132637540074e-09 3.98217682594235e-09 -3.526226198841844e-09 ] [ 3.736921877319106e-09 -2.67308685503828e-09 2.830570242497222e-09 ] [ 3.403091235085584e-09 -7.308642041526229e-09 -9.672740964142462e-09 ] [ 5.951554383851556e-09 6.193036206532816e-09 8.08861254254045e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.894855158928927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.444599118638195e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6747587 3.0371402 0.9756662 ] [ 1.9990492 1.446258 2.7534156 ] [ 1.1137528 3.0446969 4.2855183 ] [ 1.7940748 4.6898711 2.694973 ] [ 3.4331731 2.5291205 4.4868712 ] [ 3.7876735 3.0697758 2.0576594 ] [ 3.948106 4.7536505 3.7234896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6747587e-10 3.0371402e-10 9.756662e-11 ] [ 1.9990492e-10 1.446258e-10 2.7534156e-10 ] [ 1.1137528e-10 3.0446969e-10 4.2855183e-10 ] [ 1.7940748e-10 4.689871100000001e-10 2.694973e-10 ] [ 3.4331731e-10 2.5291205e-10 4.486871200000001e-10 ] [ 3.7876735e-10 3.0697758e-10 2.0576594e-10 ] [ 3.948106e-10 4.753650500000001e-10 3.7234896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.99e-05 1.39e-05 3.1e-05 ] [ -1.82e-05 3.8e-06 -4.85e-05 ] [ -2.29e-05 -4.5e-06 -3.9e-06 ] [ -4.4e-06 1.1e-06 -1.63e-05 ] [ 5.98e-05 -4.4e-06 4.49e-05 ] [ -2.8e-05 -3.72e-05 1.3e-06 ] [ -6.2e-06 2.72e-05 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.188331475392e-14 2.227025502912e-14 4.96674752448e-14 ] [ -2.915961449856e-14 6.08827115904e-15 -7.77055661088e-14 ] [ -3.668984461632e-14 -7.2097947936e-15 -6.24848882112e-15 ] [ -7.04957713152e-15 1.76239428288e-15 -2.611547891904e-14 ] [ 9.581016192383999e-14 -7.04957713152e-15 7.193773027392e-14 ] [ -4.48609453824e-14 -5.960097029376001e-14 2.08282960704e-15 ] [ -9.93349504896e-15 4.357920408576e-14 -1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.097630158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297383372452091e-18 } }