{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] "source-value" [ 5.4207 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] "source-value" [ -0.121917 5.37017 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] "source-value" [ -0.0328689 -0.300504 5.4102 ] } "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" [ [ 1.66064068656364e-09 1.123597123477341e-08 -4.551397334691864e-09 ] [ -2.549929941462315e-09 -1.660296138481337e-08 -5.80146231779735e-10 ] [ -1.381702858405995e-09 1.133286430787525e-08 3.228773617654233e-10 ] [ -1.385620020026189e-09 -6.633388843141523e-09 1.874941422655365e-09 ] [ -1.662717267681859e-09 2.62354723348782e-09 -6.59151323345666e-09 ] [ -1.16534620927446e-09 -2.669195007808694e-09 1.184812206607726e-08 ] [ 1.22281296815695e-08 9.445711095016144e-09 -8.732042828229842e-09 ] [ -5.74345423149999e-09 -8.732548635389026e-09 6.409158777660052e-09 ] ] "source-value" [ [ 1.0364903999999997 7.012941699999999 -2.8407587999999997 ] [ -1.5915410999999997 -10.362753499999998 -0.36209879999999994 ] [ -0.8623910999999999 7.073417599999999 0.20152419999999996 ] [ -0.8648359999999999 -4.140235699999999 1.1702463999999997 ] [ -1.0377864999999997 1.6374893999999998 -4.1140989999999995 ] [ -0.7273518999999999 -1.6659804999999999 7.395016199999999 ] [ 7.632198299999999 5.895549199999999 -5.4501124999999995 ] [ -3.5847821999999994 -5.450428199999999 4.000282299999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.018125343436225e-18 "source-value" -25.079166 } }