{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3317314 3.5544368 -0.8837283 ] [ -0.8101565 -0.9348906 -0.622016 ] [ 0.539309 0.0842179 -1.0165263 ] [ -0.3863257 -0.3600318 -1.7956646 ] [ 1.3623328 0.0938936 0.5708138 ] [ 0.3899497 -3.5000742 -2.0971897 ] [ -0.3829536 1.3694782 3.0089065 ] [ -3.0438871 -0.3070299 2.8354046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.735845535065253e-09 5.694835541071166e-09 -1.415888821399328e-09 ] [ -1.298013803489155e-09 -1.497859862325685e-09 -9.965794929635328e-10 ] [ 8.640682711870273e-10 1.349319504328723e-10 -1.628654672288327e-09 ] [ -6.189620045541946e-10 -5.768345327045415e-10 -2.876971840918184e-09 ] [ 2.182697761909002e-09 1.504341307627469e-10 9.14544525190007e-10 ] [ 6.247682926279737e-10 -5.607737054305263e-09 -3.360068306722566e-09 ] [ -6.135593047711949e-10 2.194145954735266e-09 4.820799648473156e-09 ] [ -4.876844747974712e-09 -4.91916127666562e-10 4.542818960628776e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.877433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.748198436691842e-18 } }