{ "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" [ [ 1.4155883 -2.6665148 0.1892554 ] [ -2.2307057 2.7498356 3.3805359 ] [ 4.0951384 -0.0321567 -1.8427544 ] [ -1.8853215 -1.032221 -1.2950461 ] [ 2.1743604 1.7916585 0.7585824 ] [ -4.3767469 1.1036267 -4.6273454 ] [ 4.239815 1.6524636 2.5071001 ] [ -3.4321282 -3.5666918 0.9296721 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.268022497623782e-09 -4.272227706775182e-09 3.032205797383235e-10 ] [ -3.573984549870614e-09 4.40572234566137e-09 5.41621562937816e-09 ] [ 6.561135057476144e-09 -5.15207133665478e-11 -2.952418041880689e-09 ] [ -3.020618054877831e-09 -1.653800367324114e-09 -2.074892601372827e-09 ] [ 3.483709426774893e-09 2.870553384807488e-09 1.215382996243641e-09 ] [ -7.012321616111933e-09 1.768204911398528e-09 -7.413824677327383e-09 ] [ 6.792932525482709e-09 2.647538568455522e-09 4.016817199319063e-09 ] [ -5.498875606932479e-09 -5.714470262639401e-09 1.489498915901711e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.881963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.108053616465254e-18 } }