{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2135895 -10.3682073 -8.9870571 ] [ -2.7392872 -9.8537139 5.8113353 ] [ 0.9985918 7.6519245 -3.9054698 ] [ -10.8517385 6.8171452 4.6628236 ] [ 2.3543813 -2.1799726 -0.1701514 ] [ 0.9309857 2.6707497 -4.3896882 ] [ 11.5206564 5.2620744 6.9782076 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.546561344948361e-09 -1.661169933566789e-08 -1.439885277541465e-08 ] [ -4.388821909496694e-09 -1.578739003863199e-08 9.310785553289754e-09 ] [ 1.599920435682589e-09 1.225973453802673e-08 -6.257252406800452e-09 ] [ -1.738640171973526e-08 1.092227066003894e-08 7.470666958834491e-09 ] [ 3.772134675308711e-09 -3.49270113370459e-09 -2.726125950763892e-10 ] [ 1.491603522839123e-09 4.279012729348614e-09 -7.033055806641635e-09 ] [ 1.845812634034989e-08 8.430772580590189e-09 1.118032107180888e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.56807799 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.101612743690563e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.6907795 0.4438741 3.2517749 ] [ 2.3530579 1.9278052 5.0213572 ] [ 3.2308365 4.7223047 3.4194703 ] [ 1.1366806 3.728606 4.0173812 ] [ 4.0826132 1.4440488 1.6462514 ] [ 3.7285517 3.7476897 1.3579318 ] [ 4.3226366 3.2881285 4.9947529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6907795e-10 4.438741e-11 3.2517749e-10 ] [ 2.3530579e-10 1.9278052e-10 5.021357199999999e-10 ] [ 3.2308365e-10 4.7223047e-10 3.4194703e-10 ] [ 1.1366806e-10 3.728606e-10 4.0173812e-10 ] [ 4.0826132e-10 1.4440488e-10 1.6462514e-10 ] [ 3.7285517e-10 3.7476897e-10 1.3579318e-10 ] [ 4.3226366e-10 3.2881285e-10 4.9947529e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.09e-05 1.82e-05 -1.54e-05 ] [ 2.2e-06 1.86e-05 1.06e-05 ] [ -7.7e-06 -1.3e-06 -4.2e-06 ] [ 8.6e-06 -4.2e-06 -1.6e-06 ] [ -5e-07 -2.57e-05 -2.3e-05 ] [ -8.8e-06 -1.3e-06 1.7e-06 ] [ -4.7e-06 -4.2e-06 3.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.746372516672e-14 2.915961449856e-14 -2.467351996032e-14 ] [ 3.52478856576e-15 2.980048514688e-14 1.698307218048e-14 ] [ -1.233675998016e-14 -2.08282960704e-15 -6.72914180736e-15 ] [ 1.377871893888e-14 -6.72914180736e-15 -2.56348259328e-15 ] [ -8.010883104e-16 -4.117593915456e-14 -3.68500622784e-14 ] [ -1.409915426304e-14 -2.08282960704e-15 2.72370025536e-15 ] [ -7.53023011776e-15 -6.72914180736e-15 5.110943420352001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.385397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.824141689192646e-18 } }