{ "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" [ [ -4.634404 0.554538 -1.4077773 ] [ -2.9522874 0.9787263 3.1000044 ] [ 0.3403711 -4.7356432 -0.0450706 ] [ 3.6112534 -0.1192459 5.7495878 ] [ -0.9900577 2.4400959 -0.371322 ] [ 5.24988 0.6619499 -7.0473357 ] [ -0.6247553 0.2195791 0.0219134 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.425133740142003e-09 8.884678189451903e-10 -2.255507877352948e-09 ] [ -4.730085850162419e-09 1.568092396022087e-09 4.966754574057131e-09 ] [ 5.453346188159789e-10 -7.5873368194905e-09 -7.221106160542848e-11 ] [ 5.785865769264511e-09 -1.910529931062547e-10 9.211855152396906e-09 ] [ -1.58624730018302e-09 3.909464603489935e-09 -5.949234271886977e-10 ] [ 8.411234998005504e-09 1.060560653920898e-09 -1.12910764974692e-08 ] [ -1.00096833538089e-09 3.518045004363053e-10 3.510913716223872e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -21.29719 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.412185990673555e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9664543 3.0227696 1.5312651 ] [ 2.4107086 2.5472747 4.0313098 ] [ 3.5742967 1.1362178 2.2588874 ] [ 4.9340375 2.711366 3.7273911 ] [ 3.1272467 5.0643148 0.6680086 ] [ 4.7101038 3.2011898 1.2008118 ] [ 3.4449194 4.7354484 3.1279853 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9664543e-10 3.0227696e-10 1.5312651e-10 ] [ 2.4107086e-10 2.5472747e-10 4.0313098e-10 ] [ 3.5742967e-10 1.1362178e-10 2.2588874e-10 ] [ 4.9340375e-10 2.711366e-10 3.7273911e-10 ] [ 3.1272467e-10 5.064314800000001e-10 6.680086e-11 ] [ 4.710103799999999e-10 3.2011898e-10 1.2008118e-10 ] [ 3.4449194e-10 4.735448400000001e-10 3.1279853e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.3e-05 -1.21e-05 -1.25e-05 ] [ -2.54e-05 -3.1e-06 1.6e-05 ] [ 5.3e-06 -2.73e-05 -6e-06 ] [ 4.96e-05 -1.08e-05 2.92e-05 ] [ -1.21e-05 4.89e-05 -4.48e-05 ] [ 3.47e-05 -2.65e-05 -1.97e-05 ] [ -9.1e-06 3.1e-05 3.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.889359469439999e-14 -1.938633711168e-14 -2.002720776e-14 ] [ -4.069528616832e-14 -4.96674752448e-15 2.56348259328e-14 ] [ 8.491536090240001e-15 -4.373942174784e-14 -9.6130597248e-15 ] [ 7.946796039168e-14 -1.730350750464e-14 4.678355732736e-14 ] [ -1.938633711168e-14 7.834643675712001e-14 -7.177751261183999e-14 ] [ 5.559552874176001e-14 -4.24576804512e-14 -3.156287942976e-14 ] [ -1.457980724928e-14 4.96674752448e-14 6.072249392832e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }