{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0460116 -1.7709828 -0.283839 ] [ -1.6806068 1.7462453 0.0164858 ] [ -2.4127486 0.799765 1.0545507 ] [ -0.5660871 -2.0227609 -3.4576868 ] [ 1.7736046 0.3233634 2.7737211 ] [ 1.6347476 1.2507501 -0.9404308 ] [ 1.297102 -0.3263801 0.837199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.371870980560128e-11 -2.837427237998922e-09 -4.547602098712512e-10 ] [ -2.692628923717502e-09 2.797793393841882e-09 2.641316333518464e-11 ] [ -3.865649398787931e-09 1.281364785134112e-09 1.689576476988275e-09 ] [ -9.069715169564716e-10 -3.240820223448367e-09 -5.539824953008765e-09 ] [ 2.841627824663336e-09 5.180852795023988e-10 4.443991099039659e-09 ] [ 2.61915438562891e-09 2.003922568683262e-09 -1.506736241240241e-09 ] [ 2.078186499192921e-09 -5.229185657143661e-10 1.341340664757139e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.520122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.486597662036374e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4135337 1.474906 3.6273062 ] [ 0.8560192 3.2080061 4.0356888 ] [ 1.8565484 5.10822 2.9419634 ] [ 3.2122155 2.0180889 1.4685965 ] [ 4.2888704 1.9492407 4.9890667 ] [ 3.8578997 4.2180695 2.0483793 ] [ 5.2893982 3.8494434 3.895321 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4135337e-10 1.474906e-10 3.6273062e-10 ] [ 8.560192e-11 3.2080061e-10 4.0356888e-10 ] [ 1.8565484e-10 5.10822e-10 2.9419634e-10 ] [ 3.2122155e-10 2.0180889e-10 1.4685965e-10 ] [ 4.288870400000001e-10 1.9492407e-10 4.9890667e-10 ] [ 3.8578997e-10 4.218069500000001e-10 2.0483793e-10 ] [ 5.289398200000001e-10 3.8494434e-10 3.895321e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -1.24e-05 -8.3e-06 ] [ -1.36e-05 2.32e-05 -4.6e-06 ] [ -3.12e-05 5.4e-06 -4.8e-06 ] [ 1.07e-05 5.5e-06 2.11e-05 ] [ 1.2e-05 5.9e-06 -3.32e-05 ] [ -7.4e-06 -2.79e-05 1.41e-05 ] [ 3.48e-05 3e-07 1.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 -1.986699009792e-14 -1.329806595264e-14 ] [ -2.178960204288e-14 3.717049760256e-14 -7.370012455680001e-15 ] [ -4.998791056896e-14 8.65175375232e-15 -7.69044777984e-15 ] [ 1.714328984256e-14 8.8119714144e-15 3.380592669888e-14 ] [ 1.92261194496e-14 9.45284206272e-15 -5.319226381056e-14 ] [ -1.185610699392e-14 -4.470072772032e-14 2.259069035328e-14 ] [ 5.575574640383999e-14 4.8065298624e-16 2.515417294656e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }