{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9756864 0.3363447 -0.9224426 ] [ -1.6129079 1.1005613 1.5825979 ] [ -0.1948394 -3.7790893 -0.2180341 ] [ 1.9989348 1.025683 2.9096256 ] [ -0.2155812 0.8197396 0.9208539 ] [ 3.4384122 0.5965859 -4.0791395 ] [ -0.4383321 -0.0998252 -0.1934612 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.767575180912517e-09 5.388836148699898e-10 -1.477915967749966e-09 ] [ -2.584163328883624e-09 1.763293584617255e-09 2.535601355507176e-09 ] [ -3.121671314906995e-10 -6.054768524375438e-09 -3.493291375571693e-10 ] [ 3.202646603063524e-09 1.643325322952006e-09 4.661734111601173e-09 ] [ -3.453991585240089e-10 1.313367622263944e-09 1.475370589752501e-09 ] [ 5.508943639513494e-09 9.558359812789267e-10 -6.535501939881802e-09 ] [ -7.022854427661677e-10 -1.599376016066842e-10 -3.09959011671913e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.397615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.986316890667939e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7825703 2.8302449 1.3590595 ] [ 2.053655 2.8753233 3.7321796 ] [ 3.5607274 1.4278067 2.3850043 ] [ 5.1538765 3.060035 3.3744906 ] [ 3.2366941 4.5834303 1.2053562 ] [ 4.8828476 3.0148853 1.0013604 ] [ 3.497396 4.6268554 3.4882085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7825703e-10 2.8302449e-10 1.3590595e-10 ] [ 2.053655e-10 2.8753233e-10 3.7321796e-10 ] [ 3.5607274e-10 1.4278067e-10 2.3850043e-10 ] [ 5.1538765e-10 3.060035e-10 3.3744906e-10 ] [ 3.2366941e-10 4.5834303e-10 1.2053562e-10 ] [ 4.8828476e-10 3.0148853e-10 1.0013604e-10 ] [ 3.497396000000001e-10 4.6268554e-10 3.4882085e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.07e-05 -1.97e-05 -1.29e-05 ] [ -9.4e-06 -1e-05 -1.9e-05 ] [ -6.4e-06 5.48e-05 2.27e-05 ] [ 8.9e-06 -6.5e-06 -1.8e-06 ] [ -2.69e-05 1.33e-05 2.7e-06 ] [ -5.8e-06 1.09e-05 3.97e-05 ] [ 5.03e-05 -4.27e-05 -3.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714328984256e-14 -3.156287942976e-14 -2.066807840832e-14 ] [ -1.506046023552e-14 -1.6021766208e-14 -3.04413557952e-14 ] [ -1.025393037312e-14 8.779927881984e-14 3.636940929216e-14 ] [ 1.425937192512e-14 -1.04141480352e-14 -2.88391791744e-15 ] [ -4.309855109952001e-14 2.130894905664e-14 4.32587687616e-15 ] [ -9.292624400640001e-15 1.746372516672e-14 6.360641184576e-14 ] [ 8.058948402624e-14 -6.841294170816001e-14 -5.04685635552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }