{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.5053408 -3.05524 -4.1675647 ] [ -1.6460113 -1.4029739 7.1348448 ] [ -1.9883221 1.7504905 -0.6638597 ] [ 9.7234265 -6.4968902 4.2694239 ] [ 4.4162479 9.2046136 -6.5728442 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.683141142329637e-08 -4.895034098932992e-09 -6.677174728011365e-09 ] [ -2.637200822432615e-09 -2.247811982172597e-09 1.143128153159645e-08 ] [ -3.18564318323996e-09 2.804594954032503e-09 -1.063620490831302e-09 ] [ 1.557864661236717e-08 -1.040916558634464e-08 6.840371156864757e-09 ] [ 7.075609137037097e-09 1.474741671341772e-08 -1.053085730940088e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.4974437 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.603522528704249e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7009137 1.6888769 0.5603901 ] [ 1.4461088 1.968952 3.1294244 ] [ 0.7374664 4.0003235 1.2476158 ] [ 4.1434657 1.2240276 1.3095301 ] [ 3.4348429 3.2553971 -0.5722446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7009137e-10 1.6888769e-10 5.603901e-11 ] [ 1.4461088e-10 1.968952e-10 3.1294244e-10 ] [ 7.374664e-11 4.0003235e-10 1.2476158e-10 ] [ 4.1434657e-10 1.2240276e-10 1.3095301e-10 ] [ 3.4348429e-10 3.2553971e-10 -5.722446e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.07e-05 -1.56e-05 -2e-05 ] [ 6.5e-06 5.1e-06 -3.7e-06 ] [ 7.3e-06 3.8e-06 1.11e-05 ] [ -9.1e-06 -1.08e-05 2.79e-05 ] [ -1.53e-05 1.75e-05 -1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.714328984256e-14 -2.499395528448e-14 -3.2043532416e-14 ] [ 1.04141480352e-14 8.17110076608e-15 -5.928053496960001e-15 ] [ 1.169588933184e-14 6.08827115904e-15 1.778416049088e-14 ] [ -1.457980724928e-14 -1.730350750464e-14 4.470072772032e-14 ] [ -2.451330229824e-14 2.8038090864e-14 -2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.196884 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.793938577060959e-18 } }