{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3134481 -1.3954124 -1.1785246 ] [ -0.5495836 -1.2320683 0.93506 ] [ -1.4262166 0.6064868 1.9694719 ] [ -3.4475445 1.407539 -1.0604459 ] [ 0.9709546 -1.1471271 -2.3326426 ] [ 4.0613622 -1.7279514 2.651595 ] [ 0.704476 3.4885333 -0.9845138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.021992176541805e-10 -2.235697123654418e-09 -1.888204561157672e-09 ] [ -8.805299950950988e-10 -1.973991025488801e-09 1.498131271045248e-09 ] [ -2.285050892716866e-09 9.716989717838055e-10 3.155441833502556e-09 ] [ -5.523575197067625e-09 2.255126078664211e-09 -1.699021628603215e-09 ] [ 1.555640759978216e-09 -1.837900220706104e-09 -3.737305438402126e-09 ] [ 6.507019565440854e-09 -2.768483334958629e-09 4.248323516830176e-09 ] [ 1.128694977114701e-09 5.589246494142272e-09 -1.577364993214967e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.241673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.60220287632786e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5082272 1.0598614 2.6359396 ] [ 1.1726029 2.1430894 4.2594168 ] [ 2.7051903 2.4699511 6.0315923 ] [ 0.8340648 4.2736695 3.2887001 ] [ 4.1738729 2.738415 2.6034983 ] [ 4.7841996 2.8823182 4.8845208 ] [ 2.9130753 4.6860723 2.1416532 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5082272e-10 1.0598614e-10 2.6359396e-10 ] [ 1.1726029e-10 2.1430894e-10 4.259416800000001e-10 ] [ 2.7051903e-10 2.4699511e-10 6.0315923e-10 ] [ 8.340648000000001e-11 4.2736695e-10 3.2887001e-10 ] [ 4.1738729e-10 2.738415e-10 2.6034983e-10 ] [ 4.7841996e-10 2.8823182e-10 4.8845208e-10 ] [ 2.9130753e-10 4.686072300000001e-10 2.1416532e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.18e-05 7.5e-06 -7.8e-06 ] [ -3.18e-05 6.6e-06 -6.4e-06 ] [ 4.6e-06 -1.3e-06 -2.11e-05 ] [ -4.27e-05 1.41e-05 3.66e-05 ] [ 8.1e-06 -1.15e-05 2.9e-06 ] [ 1.16e-05 1.65e-05 8e-07 ] [ 2.85e-05 -3.19e-05 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.492745033344e-14 1.2016324656e-14 -1.249697764224e-14 ] [ -5.094921654144e-14 1.057436569728e-14 -1.025393037312e-14 ] [ 7.370012455680001e-15 -2.08282960704e-15 -3.380592669888e-14 ] [ -6.841294170816001e-14 2.259069035328e-14 5.863966432128e-14 ] [ 1.297763062848e-14 -1.84250311392e-14 4.646312200320001e-15 ] [ 1.858524880128e-14 2.64359142432e-14 1.28174129664e-15 ] [ 4.56620336928e-14 -5.110943420352001e-14 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }