{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43103e-10 0.0 0.0 ] "source-value" [ 5.43103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] "source-value" [ 0.00138287 5.43667 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] "source-value" [ -0.0279747 -0.147199 5.47761 ] } "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" [ [ 4.905855199829875e-10 -1.26858422222999e-10 -3.385537307375113e-09 ] [ 1.509877789158305e-09 1.90812073807785e-09 -4.945233496815897e-10 ] [ 1.153841940266467e-09 -1.430947198805242e-10 1.159051577766661e-09 ] [ 1.832868585028481e-09 5.410644976862228e-10 9.014259030188966e-10 ] [ 6.860318416011379e-10 -3.591967831470144e-10 3.126794274652003e-09 ] [ -1.816823427041818e-10 -1.684317172012837e-09 -1.496845364089394e-09 ] [ -4.379005533558714e-09 3.319953489143961e-10 -7.809148239145209e-10 ] [ -1.112517959992145e-09 -4.677134874150951e-10 9.705490896230571e-10 ] ] "source-value" [ [ 0.3061994 -0.0791788 -2.1130862 ] [ 0.9423916 1.1909553 -0.3086572 ] [ 0.7201715 -0.0893127 0.7234231 ] [ 1.1439866 0.3377059 0.5626258 ] [ 0.4281874 -0.224193 1.9515915 ] [ -0.1133972 -1.0512681 -0.9342574 ] [ -2.7331603 0.2072152 -0.4874087 ] [ -0.6943791 -0.2919238 0.6057691 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.423374170402985e-17 "source-value" 151.25512 } }