{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42802e-10 0.0 0.0 ] "source-value" [ 5.42802 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] "source-value" [ -0.0476613 5.42825 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] "source-value" [ -0.0987222 -0.186163 5.49756 ] } "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" [ [ 1.540361442416295e-10 1.537419846140506e-10 -3.104561670773472e-10 ] [ -3.57477647632896e-11 -4.754651383418496e-11 -3.26733961109351e-10 ] [ -1.187214478189421e-10 2.828979281112768e-10 3.673438512637825e-11 ] [ 2.954461754053824e-11 -8.398641889766016e-11 4.375976939092416e-11 ] [ -1.513425649067405e-10 -6.891137885489088e-11 5.0456547230544e-11 ] [ 2.725134203435616e-10 1.71921562294944e-11 6.520201954241472e-11 ] [ -4.192961905875053e-10 -1.565142308210208e-10 -7.763731338475392e-11 ] [ 2.690137859507482e-10 -9.687352654706497e-11 5.18674560063529e-10 ] ] "source-value" [ [ 0.09614179999999997 0.09595819999999997 -0.19377149999999996 ] [ -0.022311999999999995 -0.029676199999999993 -0.20393129999999995 ] [ -0.07410009999999999 0.17657099999999998 0.022927799999999998 ] [ 0.018440299999999996 -0.052420199999999986 0.027312699999999992 ] [ -0.09446059999999998 -0.04301109999999999 0.03149249999999999 ] [ 0.17008949999999998 0.010730499999999999 0.04069589999999999 ] [ -0.26170409999999994 -0.09768849999999997 -0.048457399999999984 ] [ 0.16790519999999998 -0.06046369999999999 0.32373119999999994 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.821213971347294e-18 "source-value" 30.091651 } }