{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4024118 0.5721245 5.1104713 ] [ -0.6695457 -1.8760665 0.2607359 ] [ 3.0571831 1.122398 0.0078427 ] [ -1.6764254 -0.5869486 -4.6165034 ] [ -0.3088002 0.7684926 -0.7625465 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.447347832058812e-10 9.16644505638933e-10 8.187877705587604e-09 ] [ -1.072730475935174e-09 -3.005789910130161e-09 4.177449666249606e-10 ] [ 4.898147328679684e-09 1.798279849648332e-09 1.25653906874718e-11 ] [ -2.685929604524103e-09 -9.403953322790123e-10 -7.396453878261555e-09 ] [ -4.947524650145267e-10 1.231260887121908e-09 -1.221734184638481e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.026075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.087007299773155e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4108794 2.9333616 2.1580145 ] [ 3.4195121 0.7667419 1.6528116 ] [ 4.6949738 2.7930433 1.3036084 ] [ 3.0992056 2.8867535 4.4018724 ] [ 4.8358872 1.6289679 3.446477 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4108794e-10 2.9333616e-10 2.1580145e-10 ] [ 3.4195121e-10 7.667419e-11 1.6528116e-10 ] [ 4.6949738e-10 2.7930433e-10 1.3036084e-10 ] [ 3.0992056e-10 2.8867535e-10 4.4018724e-10 ] [ 4.835887200000001e-10 1.6289679e-10 3.446477e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.41e-05 -4.7e-05 1.76e-05 ] [ 2.81e-05 5.43e-05 -4.28e-05 ] [ -1.12e-05 -6.84e-05 7.2e-06 ] [ -7.4e-06 2.81e-05 5.43e-05 ] [ -4.36e-05 3.3e-05 -3.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.46342232194e-14 -7.530230179799998e-14 2.81983087584e-14 ] [ 4.50211634154e-14 8.69981912262e-14 -6.857315993519999e-14 ] [ -1.79443783008e-14 -1.095888817656e-13 1.15356717648e-14 ] [ -1.18561070916e-14 4.50211634154e-14 8.69981912262e-14 ] [ -6.985490124239999e-14 5.287182892199999e-14 -5.81590118142e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.226263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279298616773874e-18 } }