{ "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" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9215815 -3.4648786 -1.181208 ] [ -5.0303004 -0.8047449 4.5474079 ] [ -5.239223 0.5661659 -2.6514371 ] [ 0.1194651 5.4601031 2.1319684 ] [ 1.5355025 -3.4334155 -7.5724144 ] [ 5.6282388 -2.2751995 5.2465957 ] [ 6.9078985 3.9519694 -0.5209125 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.28306624762667e-09 -5.551347532566632e-09 -1.892503857493872e-09 ] [ -8.059429762880852e-09 -1.289343475110667e-09 7.285750682647008e-09 ] [ -8.39416067091538e-09 9.070977759475805e-10 -4.248070568140721e-09 ] [ 1.914041917984734e-10 8.748049606050964e-09 3.415789954906365e-09 ] [ 2.460146226948584e-09 -5.500938088913427e-09 -1.213234541464513e-08 ] [ 9.017432695932198e-09 -3.645271476588482e-09 8.405973038584874e-09 ] [ 1.106767356674365e-08 6.331753030962999e-09 -8.345938358585249e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.425318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.830537753561961e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9116304 0.9019877 2.7894819 ] [ 2.1697398 2.1949893 4.7922809 ] [ 3.0746448 5.1529286 2.4080795 ] [ 1.9450016 4.4521703 4.2976507 ] [ 4.1731232 1.4122557 2.1771472 ] [ 4.4648093 1.5427819 4.5536105 ] [ 4.2711039 3.5433284 1.2612063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9116304e-10 9.019877e-11 2.7894819e-10 ] [ 2.1697398e-10 2.1949893e-10 4.7922809e-10 ] [ 3.0746448e-10 5.1529286e-10 2.4080795e-10 ] [ 1.9450016e-10 4.4521703e-10 4.2976507e-10 ] [ 4.1731232e-10 1.4122557e-10 2.1771472e-10 ] [ 4.4648093e-10 1.5427819e-10 4.5536105e-10 ] [ 4.2711039e-10 3.5433284e-10 1.2612063e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.95e-05 -2.17e-05 -3.8e-06 ] [ 3.5e-06 3.21e-05 7.7e-06 ] [ 3.19e-05 -3.45e-05 9e-06 ] [ -3.06e-05 -1.6e-06 2.2e-06 ] [ 7.8e-06 -9.5e-06 7.5e-06 ] [ 1.19e-05 1.6e-06 -1.62e-05 ] [ -5.1e-06 3.36e-05 -6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.1242444363e-14 -3.476723295779999e-14 -6.088271209199999e-15 ] [ 5.607618218999999e-15 5.14298699514e-14 1.23367600818e-14 ] [ 5.11094346246e-14 -5.527509387299999e-14 1.4419589706e-14 ] [ -4.90266050004e-14 -2.5634826144e-15 3.5247885948e-15 ] [ 1.24969777452e-14 -1.5220678023e-14 1.2016324755e-14 ] [ 1.90659019446e-14 2.5634826144e-15 -2.59552614708e-14 ] [ -8.1711008334e-15 5.383313490239999e-14 -1.02539304576e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.396455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.947437034943247e-18 } }