{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.248575 -4.1237345 0.63829 ] [ -1.9600596 0.2128171 -5.054688 ] [ -7.3303496 3.5171617 1.1238191 ] [ -0.5809488 1.4593239 3.013537 ] [ -1.2289351 -7.9735739 2.2211559 ] [ 4.3639827 8.5380769 -4.2766559 ] [ 8.9848854 -1.6300711 2.334542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.60261432479655e-09 -6.606951060719673e-09 1.02265332371586e-09 ] [ -3.140361692367386e-09 3.409705849356414e-10 -8.09850300576019e-09 ] [ -1.174451484817125e-08 5.635114293739717e-09 1.800556702862909e-09 ] [ -9.307825929103392e-10 2.338094654017752e-09 4.828218567094458e-09 ] [ -1.968971101922453e-09 -1.277507379205225e-08 3.55868408345124e-09 ] [ 6.991871113120231e-09 1.367950730847515e-08 -6.851958154638239e-09 ] [ 1.439537344704774e-08 -2.611661828178677e-09 3.740348643491627e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.339731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.816825204404545e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8104959 1.7333713 3.822074 ] [ 2.2942134 3.5750264 0.7698536 ] [ 1.1115148 3.9732454 2.9255687 ] [ 3.1167965 5.0672672 3.7313523 ] [ 3.4321575 1.7177496 1.8295346 ] [ 4.1107314 5.2040976 1.3662786 ] [ 4.5329334 3.0869394 3.5273001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8104959e-10 1.7333713e-10 3.822074e-10 ] [ 2.2942134e-10 3.5750264e-10 7.698536000000001e-11 ] [ 1.1115148e-10 3.9732454e-10 2.9255687e-10 ] [ 3.1167965e-10 5.0672672e-10 3.7313523e-10 ] [ 3.4321575e-10 1.7177496e-10 1.8295346e-10 ] [ 4.1107314e-10 5.2040976e-10 1.3662786e-10 ] [ 4.5329334e-10 3.0869394e-10 3.5273001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.06e-05 -2.51e-05 1.45e-05 ] [ -2.88e-05 9.9e-06 -2.51e-05 ] [ 1.4e-05 -5.4e-06 6.6e-06 ] [ -1.87e-05 3.06e-05 -1.95e-05 ] [ -1.71e-05 1.69e-05 -1.82e-05 ] [ 2.6e-05 1.07e-05 -1.76e-05 ] [ -5.8e-06 -3.76e-05 5.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.90266050004e-14 -4.02146335134e-14 2.3231561193e-14 ] [ -4.614268705919999e-14 1.58615486766e-14 -4.02146335134e-14 ] [ 2.243047287599999e-14 -8.6517538236e-15 1.05743657844e-14 ] [ -2.99607030558e-14 4.90266050004e-14 -3.1242444363e-14 ] [ -2.73972204414e-14 2.70767851146e-14 -2.915961473879999e-14 ] [ 4.165659248399999e-14 1.71432899838e-14 -2.81983087584e-14 ] [ -9.2926244772e-15 -6.024184143839999e-14 9.500907439619998e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.998378080803613e-18 } }