{ "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" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6401253 0.4068865 -2.667389 ] [ -4.358548 -2.2049566 2.4564197 ] [ -1.7340703 -2.1251355 0.6481851 ] [ 1.9543366 1.4043607 -1.5140362 ] [ -2.7119815 0.0478381 -14.1849848 ] [ 4.2101379 2.4710068 15.2618052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.229947031642586e-09 6.519040376191393e-10 -4.273628294379092e-09 ] [ -6.983163706234598e-09 -3.532729914398657e-09 3.93561821421255e-09 ] [ -2.778286893483643e-09 -3.404842414132118e-09 1.03850701317091e-09 ] [ 3.131192409693762e-09 2.250033880710323e-09 -2.425753402684873e-09 ] [ -4.345073355342115e-09 7.664508540349247e-11 -2.272685101296337e-08 ] [ 6.745384513724009e-09 3.958989324797822e-09 2.445210748264387e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.263159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.445427650935311e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4863466 0.7592777 0.7068556 ] [ 0.4819201 1.7058942 2.9359035 ] [ 2.6579101 1.1384204 -0.2949663 ] [ 2.5196059 0.6599972 2.0685724 ] [ 1.7137623 2.8330565 1.1441676 ] [ 2.6506582 2.6931097 3.3660986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.863466000000001e-11 7.592777000000001e-11 7.068556e-11 ] [ 4.819201e-11 1.7058942e-10 2.9359035e-10 ] [ 2.6579101e-10 1.1384204e-10 -2.949663e-11 ] [ 2.5196059e-10 6.599972e-11 2.0685724e-10 ] [ 1.7137623e-10 2.8330565e-10 1.1441676e-10 ] [ 2.6506582e-10 2.6931097e-10 3.3660986e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.98e-05 0.0001213 3.26e-05 ] [ 4.68e-05 -6.99e-05 -1.2e-06 ] [ 4.9e-06 4.7e-06 6.29e-05 ] [ -7.74e-05 2.41e-05 -2.74e-05 ] [ -1.96e-05 -0.0001059 -1.18e-05 ] [ -1.44e-05 2.57e-05 -5.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.581016192383999e-14 1.9434402410304e-13 5.223095783807999e-14 ] [ 7.498186585344001e-14 -1.1199214579392e-13 -1.92261194496e-15 ] [ 7.850665441919999e-15 7.53023011776e-15 1.0077690944832e-13 ] [ -1.2400847044992e-13 3.861245656128e-14 -4.389963940992e-14 ] [ -3.140266176767999e-14 -1.6967050414272e-13 -1.890568412544e-14 ] [ -2.307134333952e-14 4.117593915456e-14 -8.827993180608e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }