{ "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" [ [ 2.688208678638376e-09 -5.449605105750221e-10 -5.002520924069223e-09 ] [ 1.916577506935419e-09 4.192450651315355e-09 -1.669534368985701e-09 ] [ 1.914575747465391e-09 3.98004705256032e-11 1.385363351331537e-09 ] [ 2.555412589858692e-09 -3.987803189581613e-10 2.075338790467112e-09 ] [ 1.132316857583681e-09 -6.400493725841779e-10 5.777587322664837e-09 ] [ -2.116417157065465e-09 -4.323772577386241e-09 -2.812683863137936e-09 ] [ -5.706517331248742e-09 1.474457509296307e-09 -1.217181910140188e-09 ] [ -2.384156731949691e-09 2.008541483663367e-10 1.463631601869561e-09 ] ] "source-value" [ [ 1.6778479 -0.3401376 -3.122328 ] [ 1.1962336 2.6167219 -1.0420414 ] [ 1.1949842 0.0248415 0.8646758 ] [ 1.5949631 -0.2488991 1.2953246 ] [ 0.7067366 -0.3994874 3.6060864 ] [ -1.3209637 -2.6986866 -1.7555392 ] [ -3.561728 0.920284 -0.7597052 ] [ -1.4880736 0.1253633 0.913527 ] ] } "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" -5.7124035679359e-18 "source-value" -35.654019 } }