{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0606033 -1.2821423 -4.8102614 ] [ -1.9961646 -3.2159276 3.0882523 ] [ -1.0322885 3.7888904 2.9018227 ] [ 1.1534481 -6.6979592 -3.6642475 ] [ 6.1678979 -8.4762992 2.0746131 ] [ 0.3544335 10.3604845 -3.2106596 ] [ -1.5867232 5.5229533 3.6204805 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.903627052803329e-09 -2.05421841759874e-09 -7.706888355016677e-09 ] [ -3.198208253388584e-09 -5.152484014905455e-09 4.947925634191828e-09 ] [ -1.653908500620701e-09 6.07047161765356e-09 4.649232487646732e-09 ] [ 1.848027579126181e-09 -1.073131363731227e-08 -5.870771677324848e-09 ] [ 9.882061814861417e-09 -1.358052840914574e-08 3.323896606025413e-09 ] [ 5.678650673283168e-10 1.659932604606078e-08 -5.14404374846708e-09 ] [ -2.542210814720963e-09 8.84874665503021e-09 5.800649213162295e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.436235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992504496777469e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5946199 2.4671672 0.8113598 ] [ 2.7410426 1.5112042 3.6904015 ] [ 1.9504425 3.8070343 2.8200622 ] [ 3.8908454 1.7665649 1.2864789 ] [ 5.2946409 1.3604604 3.400258 ] [ 4.2330586 4.2186648 1.7070201 ] [ 4.2889521 3.5994832 4.1566206 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5946199e-10 2.4671672e-10 8.113598e-11 ] [ 2.7410426e-10 1.5112042e-10 3.6904015e-10 ] [ 1.9504425e-10 3.8070343e-10 2.8200622e-10 ] [ 3.8908454e-10 1.7665649e-10 1.2864789e-10 ] [ 5.294640900000001e-10 1.3604604e-10 3.400258e-10 ] [ 4.2330586e-10 4.2186648e-10 1.7070201e-10 ] [ 4.288952100000001e-10 3.5994832e-10 4.1566206e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.6e-06 1.93e-05 1.4e-06 ] [ 1.04e-05 -1.5e-06 4.9e-06 ] [ -1.01e-05 -4e-06 -1.09e-05 ] [ 2.39e-05 1.8e-06 1.41e-05 ] [ -1.66e-05 1.87e-05 -1.98e-05 ] [ -9e-07 -4.11e-05 3.01e-05 ] [ 2.9e-06 6.9e-06 -1.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.538089555968e-14 3.092200878144e-14 2.24304726912e-15 ] [ 1.666263685632e-14 -2.4032649312e-15 7.850665441919999e-15 ] [ -1.618198387008e-14 -6.4087064832e-15 -1.746372516672e-14 ] [ 3.829202123712e-14 2.88391791744e-15 2.259069035328e-14 ] [ -2.659613190528e-14 2.996070280896e-14 -3.172309709184e-14 ] [ -1.44195895872e-15 -6.584945911488e-14 4.822551628608e-14 ] [ 4.646312200320001e-15 1.105501868352e-14 -3.188331475392e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.543705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650593737241206e-18 } }