{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.039746 -46.9574273 -66.5289297 ] [ -64.108852 -58.8116924 20.3460965 ] [ -67.2160211 52.5156512 43.5620438 ] [ 55.7391876 12.5627144 -81.9827016 ] [ 67.9792222 -49.0464677 49.4250126 ] [ 40.6462093 89.7372217 35.1784784 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.293550859837032e-08 -7.523409219297568e-08 -1.065910957721868e-07 ] [ -1.027137038607273e-07 -9.422671859296104e-08 3.259804013684071e-08 ] [ -1.076919375496195e-07 8.413934857872747e-08 6.97940881306256e-08 ] [ 8.930402323510526e-08 2.01276873054675e-08 -1.313507678135427e-07 ] [ 1.089147205090083e-07 -7.858110388176234e-08 7.918759967046543e-08 ] [ 6.512240626460355e-08 1.437748786232864e-07 5.636213564779779e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 101.12583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.620214405849953e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9181689 -0.15926 0.1032328 ] [ 0.3959791 -0.2662294 2.4313788 ] [ 0.1120782 2.1899033 2.7903062 ] [ 2.4452045 1.6797403 0.0181326 ] [ 2.7263287 0.0416619 3.2779582 ] [ 2.5594846 2.3392248 2.3108151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.181689e-11 -1.5926e-11 1.032328e-11 ] [ 3.959791e-11 -2.662294e-11 2.4313788e-10 ] [ 1.120782e-11 2.1899033e-10 2.7903062e-10 ] [ 2.4452045e-10 1.6797403e-10 1.81326e-12 ] [ 2.7263287e-10 4.16619e-12 3.2779582e-10 ] [ 2.5594846e-10 2.3392248e-10 2.3108151e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.75e-05 -2.89e-05 -2e-07 ] [ 2.63e-05 1.56e-05 -1.25e-05 ] [ -2.96e-05 1.29e-05 -8.7e-06 ] [ 1.95e-05 -3e-06 2.55e-05 ] [ 1.71e-05 -3.04e-05 -1.38e-05 ] [ 4.1e-06 3.38e-05 9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.008162327999999e-14 -4.630290434112001e-14 -3.2043532416e-16 ] [ 4.213724512704e-14 2.499395528448e-14 -2.002720776e-14 ] [ -4.742442797568e-14 2.066807840832e-14 -1.393893660096e-14 ] [ 3.12424441056e-14 -4.8065298624e-15 4.08555038304e-14 ] [ 2.739722021568e-14 -4.870616927232e-14 -2.211003736704e-14 ] [ 6.568924145279999e-15 5.415356978304e-14 1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }