{ "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" [ [ -0.4264229 -0.5409771 0.2017592 ] [ -0.5233242 -0.2610694 -2.9884315 ] [ -4.5696428 -0.4196907 1.3387613 ] [ 0.7743211 3.4966131 1.4240537 ] [ -0.8594002 -4.6637014 -3.7041446 ] [ 1.4070535 3.0092216 -2.7958272 ] [ 4.1974154 -0.6203961 6.523829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.832048009537363e-10 -8.667408620081837e-10 3.232538732713114e-10 ] [ -8.384577983388634e-10 -4.182792890862835e-10 -4.787995082162275e-09 ] [ -7.32137485956705e-09 -6.724186275071866e-10 2.144932055691815e-09 ] [ 1.240599163412139e-09 5.602191760803012e-09 2.281585544903737e-09 ] [ -1.376910908350844e-09 -7.472073349472229e-09 -5.934693878182568e-09 ] [ 2.254348221914813e-09 4.82130449432637e-09 -4.479408975636726e-09 ] [ 6.72500082166588e-09 -9.93984127055499e-10 1.045232630189704e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.618244 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.861447891154988e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1779029 2.0623979 3.7438759 ] [ 2.2885368 3.6211659 0.8698557 ] [ 1.1777385 3.9145519 2.8601615 ] [ 2.9327052 5.096089 3.7179688 ] [ 3.3326299 1.7574091 1.6748623 ] [ 4.0874248 4.7911167 1.6489451 ] [ 4.4119049 3.1149663 3.4562928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1779029e-10 2.0623979e-10 3.7438759e-10 ] [ 2.2885368e-10 3.6211659e-10 8.698557e-11 ] [ 1.1777385e-10 3.9145519e-10 2.8601615e-10 ] [ 2.9327052e-10 5.096089e-10 3.7179688e-10 ] [ 3.3326299e-10 1.7574091e-10 1.6748623e-10 ] [ 4.0874248e-10 4.7911167e-10 1.6489451e-10 ] [ 4.4119049e-10 3.1149663e-10 3.4562928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.65e-05 -4e-06 -6.4e-06 ] [ 1.8e-06 1.62e-05 2.36e-05 ] [ -1.85e-05 1.98e-05 -8e-07 ] [ -3.9e-06 -1.49e-05 -2.66e-05 ] [ 6.9e-06 -6.2e-06 4.2e-06 ] [ -1.9e-06 3.2e-06 -7.9e-06 ] [ -1.1e-05 -1.42e-05 1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.24576804512e-14 -6.4087064832e-15 -1.025393037312e-14 ] [ 2.88391791744e-15 2.595526125696e-14 3.781136825088e-14 ] [ -2.96402674848e-14 3.172309709184e-14 -1.28174129664e-15 ] [ -6.24848882112e-15 -2.387243164992e-14 -4.261789811328e-14 ] [ 1.105501868352e-14 -9.93349504896e-15 6.72914180736e-15 ] [ -3.04413557952e-15 5.126965186560001e-15 -1.265719530432e-14 ] [ -1.76239428288e-14 -2.275090801536e-14 2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }