{ "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" [ [ 2.3379419 -3.4204042 0.8776886 ] [ -1.3575463 1.9967024 3.2475573 ] [ 3.4708178 0.3214395 -1.4936042 ] [ -1.6013231 -0.5331307 -1.107407 ] [ 1.1712018 0.9970498 -0.2411915 ] [ -4.889387 3.1159472 -5.6987199 ] [ 3.5808732 0.781406 1.8543437 ] [ -2.7125783 -3.25901 2.5613329 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.745795852968732e-09 -5.480091642926127e-09 1.406212155262683e-09 ] [ -2.175028943513543e-09 3.19906990397525e-09 5.203160380768372e-09 ] [ 5.56086313421649e-09 5.150028519016417e-10 -2.393017729968687e-09 ] [ -2.565602433166981e-09 -8.541695433707384e-10 -1.774261605110266e-09 ] [ 1.876472142198878e-09 1.597449879333316e-09 -3.864313824356832e-10 ] [ -7.83366154144345e-09 4.992297755487222e-09 -9.130355792267713e-09 ] [ 5.737191323089283e-09 1.251950424552845e-09 2.970986123067769e-09 ] [ -4.346029534349409e-09 -5.221509628953408e-09 4.103707690465864e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.087085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.859176445022237e-18 } }