{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -445.7519742 -293.7284553 -66.2182184 ] [ -64.0089028 32.8709423 60.4524787 ] [ 261.5861768 -260.0747341 -93.6369308 ] [ 520.3908788 128.2619209 343.9715012 ] [ -272.2161787 392.6703263 -244.5688307 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.141733917386847e-07 -4.706048639453579e-07 -1.060932813915084e-07 ] [ -1.025535675892197e-07 5.266505525672578e-08 9.685554804254998e-08 ] [ 4.191072567934153e-07 -4.166856586357965e-07 -1.500229013712275e-07 ] [ 8.337580996909264e-07 2.054982510048789e-07 5.511030974441192e-07 ] [ -4.361383973166549e-07 6.291272164797674e-07 -3.918424627239334e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 447.3718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.167686387652134e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2308808 0.1654566 2.2880001 ] [ -0.2873625 3.2349172 1.9528354 ] [ 3.6516242 1.1847797 0.1330307 ] [ 3.0094918 -0.2062128 2.5190517 ] [ 0.9873544 1.8039868 -0.5230538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.308808e-11 1.654566e-11 2.2880001e-10 ] [ -2.873625e-11 3.2349172e-10 1.9528354e-10 ] [ 3.6516242e-10 1.1847797e-10 1.330307e-11 ] [ 3.0094918e-10 -2.062128e-11 2.5190517e-10 ] [ 9.873544e-11 1.8039868e-10 -5.230538e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.2e-06 -2.1e-05 -7.4e-06 ] [ 4.9e-06 -6e-07 4.3e-06 ] [ 5e-06 -1.22e-05 -2.2e-05 ] [ 7e-07 1.57e-05 2.62e-05 ] [ -2.4e-06 1.81e-05 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.313784829056e-14 -3.36457090368e-14 -1.185610699392e-14 ] [ 7.850665441919999e-15 -9.6130597248e-16 6.889359469440001e-15 ] [ 8.010883104e-15 -1.954655477376e-14 -3.52478856576e-14 ] [ 1.12152363456e-15 2.515417294656e-14 4.197702746496e-14 ] [ -3.84522388992e-15 2.899939683648e-14 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.673165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.870247205374083e-18 } }