{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6024195 0.2915746 -3.2544206 ] [ 0.7700293 2.5012593 -0.5612384 ] [ 1.2835552 -0.1780289 0.865962 ] [ 0.8106376 -0.1404778 0.6336297 ] [ 0.758369 -0.7016603 2.7366146 ] [ -0.58718 -2.3405414 -1.2927864 ] [ -2.7333778 0.813652 -0.3618865 ] [ -1.9044529 -0.2457776 1.2341257 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.567359059614026e-09 4.671540073391117e-10 -5.214156599569908e-09 ] [ 1.23372294179099e-09 4.007459173018574e-09 -8.992030431751988e-10 ] [ 2.056482132946268e-09 -2.852337414067411e-10 1.387424070901209e-09 ] [ 1.298784610661422e-09 -2.250702469014183e-10 1.015186691584518e-09 ] [ 1.215041081739475e-09 -1.124183728403514e-09 4.384539932259944e-09 ] [ -9.40766068201344e-10 -3.749960711094502e-09 -2.071272145768197e-09 ] [ -4.379354006973738e-09 1.303614211867162e-09 -5.798060896831392e-10 ] [ -3.05126991179476e-09 -3.937791246363341e-10 1.977287343668435e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.660163 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.713387945251719e-18 } }