{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.016822 2.865015 1.800417 ] [ 3.017685 2.615068 0.4874695 ] [ 2.867855 3.717713 2.632514 ] [ 4.355038 2.108121 2.666129 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.016822e-10 2.865015e-10 1.800417e-10 ] [ 3.017685e-10 2.615068e-10 4.874695e-11 ] [ 2.867855e-10 3.717713e-10 2.632514e-10 ] [ 4.355038000000001e-10 2.108121e-10 2.666129e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9003159 -0.5555127 -0.1601978 ] [ 0.8267757 -1.3548748 -3.8492462 ] [ 0.3835612 3.2444497 3.3525759 ] [ 1.6899789 -1.3340622 0.6568681 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.64681832791451e-09 -8.900294604974842e-10 -2.566651698635942e-10 ] [ 1.324640697185554e-09 -2.170748728671076e-09 -6.167172269343241e-09 ] [ 6.14532787285993e-10 5.198181456701575e-09 5.371418726437519e-09 ] [ 2.707644683225301e-09 -2.137403267533014e-09 1.052418712769316e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4374439 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.109568872691573e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2733452 3.1858413 1.5393766 ] [ 2.9436371 1.9994846 0.5070926 ] [ 2.6850555 3.6534529 3.2861838 ] [ 4.3553622 2.4671382 2.2538765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2733452e-10 3.1858413e-10 1.5393766e-10 ] [ 2.9436371e-10 1.9994846e-10 5.070926e-11 ] [ 2.6850555e-10 3.6534529e-10 3.2861838e-10 ] [ 4.3553622e-10 2.4671382e-10 2.2538765e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.6e-06 -1.63e-05 1.7e-06 ] [ 1.9e-06 -3.4e-06 -3.98e-05 ] [ 6.3e-06 3.19e-05 2.59e-05 ] [ -1.6e-06 -1.22e-05 1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.057436569728e-14 -2.611547891904e-14 2.72370025536e-15 ] [ 3.04413557952e-15 -5.44740051072e-15 -6.376662950784e-14 ] [ 1.009371271104e-14 5.110943420352001e-14 4.149637447872e-14 ] [ -2.56348259328e-15 -1.954655477376e-14 1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.5960346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056801242610788e-18 } }