{ "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" [ [ 5.1553025 -6.8854753 2.2040984 ] [ -3.5157599 4.9077367 7.5864675 ] [ 6.1798372 -1.2077265 -4.1547301 ] [ -2.9748729 -0.3442492 -2.2132988 ] [ 2.0696722 1.0055196 -0.5647597 ] [ -8.9415067 4.9211034 -7.3327029 ] [ 5.4960536 0.7312986 1.8302178 ] [ -3.4687261 -3.1282072 2.6447077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.259705206701784e-09 -1.103174763964414e-08 3.531354955516785e-09 ] [ -5.632868362534175e-09 7.863061066564266e-09 1.21548609631004e-08 ] [ 9.901190763763984e-09 -1.9349911785626e-09 -6.656611486796483e-09 ] [ -4.766271849499818e-09 -5.515480245131926e-10 -3.546095621420239e-09 ] [ 3.315980438879374e-09 1.611020008149026e-09 -9.048447951648497e-10 ] [ -1.432587310749444e-08 7.884476880977954e-09 -1.174828525044404e-08 ] [ 8.80564865713158e-09 1.171669529396912e-09 2.932332194290885e-09 ] [ -5.557511907165947e-09 -5.011940482150565e-09 4.237288880699882e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.301829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.854888239126358e-18 } }