{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1410528 0.4547735 0.89472 ] [ -0.2507735 -1.2889691 -0.0187762 ] [ -0.2182182 -1.042897 1.5344161 ] [ 0.1046593 0.131389 -0.2578647 ] [ -1.1689848 0.9229548 0.8986812 ] [ 0.9609978 -0.200829 -0.5254684 ] [ 0.6299812 1.6033001 0.0551699 ] [ -0.1987148 -0.5797223 -2.5808779 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.259915003202752e-10 7.286274754623989e-10 1.43349947797248e-09 ] [ -4.017834421263989e-10 -2.065156173968009e-09 -3.00827889153108e-11 ] [ -3.496241011535388e-10 -1.670905205068698e-09 2.458405622253407e-09 ] [ 1.676826849907962e-10 2.10508385764626e-10 -4.131447970734198e-10 ] [ -1.872920132061163e-09 1.478736614798143e-09 1.439846020055081e-09 ] [ 1.539688220485405e-09 -3.21763531229586e-10 -8.418931923853655e-10 ] [ 1.009341158499281e-09 2.568769957509863e-09 8.839192468011659e-11 ] [ -3.183762093899832e-10 -9.288175232687381e-10 -4.135022266586988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.903554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.271730539435723e-18 } }