{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.39143 0 0 ] "si-unit" "m" "si-value" [ 5.39143e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.144963 5.17841 0 ] "si-unit" "m" "si-value" [ 1.44963e-11 5.178410000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.144779 0.421312 5.38784 ] "si-unit" "m" "si-value" [ -1.44779e-11 4.21312e-11 5.38784e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.15223 0.0692904 -0.00428898 ] [ 1.42734 1.24068 1.17973 ] [ -0.332931 2.76994 2.80275 ] [ 1.2591 4.25807 3.96691 ] [ 2.6931 0.104845 2.7319 ] [ 4.09744 1.52781 4.38962 ] [ 2.50984 2.47613 -0.202936 ] [ 4.16866 4.11218 1.07304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5223e-11 6.929040000000001e-12 -4.288980000000001e-13 ] [ 1.42734e-10 1.24068e-10 1.17973e-10 ] [ -3.32931e-11 2.76994e-10 2.80275e-10 ] [ 1.2591e-10 4.25807e-10 3.96691e-10 ] [ 2.6931e-10 1.04845e-11 2.7319e-10 ] [ 4.09744e-10 1.52781e-10 4.38962e-10 ] [ 2.50984e-10 2.47613e-10 -2.02936e-11 ] [ 4.16866e-10 4.11218e-10 1.07304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.7171867 -7.0879946 2.084582 ] [ -0.1244678 1.9294079 4.6388891 ] [ 2.2532647 1.190819 -1.3504643 ] [ -2.5902299 0.1314385 -1.8210937 ] [ 1.6034693 0.6871947 -0.7931723 ] [ -8.5177685 5.5650868 -5.9235269 ] [ 4.4641919 -0.269447 0.8643993 ] [ -2.8056465 -2.1465052 2.3003869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.159942867488704e-09 -1.135621923647665e-08 3.339868544540506e-09 ] [ -1.994193992024103e-10 3.091252229366825e-09 7.432319662503953e-09 ] [ 3.610128022813925e-09 1.907902361404435e-09 -2.163682328685038e-09 ] [ -4.150005788277123e-09 2.105876917730208e-10 -2.917713750426169e-09 ] [ 2.569041024630541e-09 1.10100728227767e-09 -1.270802115326164e-09 ] [ -1.364696955208669e-08 8.916251963682684e-09 -9.4905363118599e-09 ] [ 7.152423892944732e-09 -4.317016839446976e-10 1.384920349495885e-09 ] [ -4.495141228529347e-09 -3.439080447865628e-09 3.685626109974587e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.645136 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.749674381963643e-18 } }