{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2468802 -0.1348409 -1.4842972 ] [ 0.4973212 0.1489523 -0.1159834 ] [ 0.4765816 2.1810445 -3.098278 ] [ -0.4906246 -0.2407241 3.107876 ] [ 0.8093856 0.0360267 -2.076843 ] [ -1.4041503 -1.7959128 4.1214033 ] [ -0.506874 -0.1960499 -1.2926043 ] [ 0.8652407 0.0015041 0.8387265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.955456878372468e-10 -2.160389392875306e-10 -2.378106291751625e-09 ] [ 7.967964062328407e-10 2.386478946405582e-10 -1.858258934118756e-10 ] [ 7.635679037143343e-10 3.494418535614213e-09 -4.963988617236252e-09 ] [ -7.860672701855963e-10 -3.856825282606794e-10 4.979366308569384e-09 ] [ 1.29677869621607e-09 5.77211369401278e-11 -3.327469327086462e-09 ] [ -2.24969680128409e-09 -2.877369524861515e-09 6.603216066550492e-09 ] [ -8.12101679182116e-10 -3.141065688780366e-10 -2.070980406467926e-09 ] [ 1.386268432325804e-09 2.4098338751994e-12 1.343788000616601e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.751284 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.727987186029805e-18 } }