{ "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" [ [ 1.2561163 0.1000795 -2.917831 ] [ 0.8975396 2.2668232 -0.5539545 ] [ 0.9376574 -0.1902225 0.7810495 ] [ 0.9038615 -0.0368783 0.7149947 ] [ 0.4440204 -0.6575904 2.5874844 ] [ -0.4524913 -2.094772 -1.3176538 ] [ -2.655077 0.5507849 -0.3031502 ] [ -1.3316269 0.0617756 1.0090608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.012520185446534e-09 1.60345036442403e-10 -4.674880650160854e-09 ] [ 1.438016975209706e-09 3.631851164449109e-09 -8.875329561991529e-10 ] [ 1.502292776977191e-09 -3.047700447610649e-10 1.251379258897383e-09 ] [ 1.448145775672191e-09 -5.90855505616422e-11 1.14554780177384e-09 ] [ 7.113991098993335e-10 -1.053575973622714e-09 4.145607046519509e-09 ] [ -7.249709879482842e-10 -3.356194751957447e-09 -2.111114130061309e-09 ] [ -4.253902330870818e-09 8.824546971400265e-10 -4.857001670324267e-10 ] [ -2.133501504385854e-09 9.897542287133039e-11 1.616693636045347e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.801222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.735988135704675e-18 } }