{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1448836 -1.3885079 -0.5265367 ] [ -18.7180074 0.1721203 -19.2929919 ] [ -5.1564135 7.0167531 12.7448713 ] [ 1.1412045 -5.445075 3.4994337 ] [ 17.35798 7.6258749 -21.8660205 ] [ 6.52012 -7.9811655 25.4412441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.834305737457339e-09 -2.224634895176104e-09 -8.436047907331833e-10 ] [ -2.99895538442414e-08 2.757671206250822e-10 -3.091078056746377e-08 ] [ -8.261485156877501e-09 1.124207777074592e-08 2.04195348319649e-08 ] [ 1.828411169451754e-09 -8.72397186350256e-09 5.606710860179641e-09 ] [ 2.781054974031398e-08 1.221799847792554e-08 -3.503322683503353e-08 ] [ 1.04463838288105e-08 -1.278723677083554e-08 4.076136650108594e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.8702289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.200790260724502e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0035574 0.001223 0.0940385 ] [ -0.1240443 2.1911009 -0.0352963 ] [ 0.2128941 3.2548481 2.722574 ] [ 1.984473 -0.1278167 2.6442513 ] [ 2.634905 2.4328686 -0.1136353 ] [ 1.610706 1.8532604 1.7510867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.5574e-13 1.223e-13 9.40385e-12 ] [ -1.240443e-11 2.1911009e-10 -3.529630000000001e-12 ] [ 2.128941e-11 3.2548481e-10 2.722574e-10 ] [ 1.984473e-10 -1.278167e-11 2.6442513e-10 ] [ 2.634905e-10 2.4328686e-10 -1.136353e-11 ] [ 1.610706e-10 1.8532604e-10 1.7510867e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1e-06 -1e-07 ] [ 1e-07 -1e-06 1e-07 ] [ 8e-06 -0.0001162 2.69e-05 ] [ -7.13e-05 3.16e-05 3.29e-05 ] [ -3.99e-05 -4.39e-05 4.27e-05 ] [ 0.0001032 0.0001286 -0.0001026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 1.6021766208e-15 -1.6021766208e-16 ] [ 1.6021766208e-16 -1.6021766208e-15 1.6021766208e-16 ] [ 1.28174129664e-14 -1.8617292333696e-13 4.309855109952001e-14 ] [ -1.1423519306304e-13 5.062878121728e-14 5.271161082432e-14 ] [ -6.392684716992e-14 -7.033555365312e-14 6.841294170816001e-14 ] [ 1.6534462726656e-13 2.0603991343488e-13 -1.6438332129408e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.396076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665634991525998e-18 } }