{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] "source-value" [ 5.51626 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] "source-value" [ 0.0156708 5.55287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] "source-value" [ 0.0707378 -0.0779479 5.31818 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.520937393647862e-09 4.178502261872333e-10 9.070594764529537e-11 ] [ -8.088989214264e-11 -8.214349921781876e-10 1.10668267252153e-09 ] [ -2.665658683571265e-09 1.875418070200053e-09 -1.524286003291498e-09 ] [ 3.474677127373577e-09 2.477268668226442e-09 -4.351474371377536e-09 ] [ -1.779780142262949e-09 -1.868697740364108e-09 4.543627579169293e-09 ] [ 1.565657728429119e-09 -2.10666887363387e-09 -4.608604973549473e-10 ] [ -1.20477369308274e-09 -7.345133857112217e-10 -1.257596655182206e-09 ] [ 5.211705109122422e-09 7.607778670559961e-10 1.853201327870068e-09 ] ] "source-value" [ [ -2.8217472 0.2608016 0.0566142 ] [ -0.0504875 -0.5126994 0.690737 ] [ -1.6637733 1.1705439 -0.9513845 ] [ 2.1687229 1.5461895 -2.7159767 ] [ -1.1108514 -1.1663494 2.8359093 ] [ 0.9772067 -1.3148793 -0.2876465 ] [ -0.7519606 -0.4584472 -0.7849301 ] [ 3.2528905 0.4748402 1.1566773 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.721780627044457e-18 "source-value" -35.712546 } }