{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.14417460000000004 0.4093245000000001 0.4264810000000001 ] [ -0.7134851000000001 -0.26272850000000003 -0.05848200000000001 ] [ 0.37299570000000004 -0.5147961000000001 0.4794036000000001 ] [ -0.7332050000000001 -0.4048944000000001 1.2365580000000003 ] [ -0.03987040000000001 0.7478747000000001 -0.3533778000000001 ] [ 0.4654049000000001 0.3203984000000001 0.40246510000000013 ] [ 1.0431766000000002 0.17462020000000003 -0.8423060000000002 ] [ -0.25084210000000007 -0.4697988000000001 -1.2907420000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.309931734331918e-10 6.558101442206497e-10 6.83297887415405e-10 ] [ -1.14312914650915e-09 -4.209374603178529e-10 -9.369849313762562e-11 ] [ 5.976049901989307e-10 -8.24794275899019e-10 7.680892398473551e-10 ] [ -1.174723909253664e-09 -6.487123415728437e-10 1.981184317863207e-09 ] [ -6.387942274194433e-11 1.198227359627814e-09 -5.661736494697384e-10 ] [ 7.456608499857622e-10 5.133348258217268e-10 6.448201739079343e-10 ] [ 1.671353159885634e-09 2.797724019594202e-10 -1.349522980759565e-09 ] [ -4.018933481323758e-10 -7.527006538398952e-10 -2.067996655884634e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 154.85918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.48111757712259e-17 } }