{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3538272999999994 8.239708999999998 2.3249403999999996 ] [ -4.790291899999999 -8.277188399999998 -2.6298661999999995 ] [ 0.13760939999999997 4.833007799999999 -4.580466299999999 ] [ -3.2128838999999996 1.1726672999999999 -4.0530238999999995 ] [ -2.6718527999999995 -0.23723949999999996 -6.485022899999999 ] [ -0.5838573999999999 1.6820295999999997 10.618815099999999 ] [ 8.054798199999999 -2.1433273999999995 1.7910043999999998 ] [ 0.7126510999999999 -5.269658399999999 3.0136194999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.771247069460787e-09 1.320146912199535e-08 3.724965153633399e-09 ] [ -7.674893688987609e-09 -1.326151774043696e-08 -4.213510141472136e-09 ] [ 2.204745634823155e-10 7.743332105304041e-09 -7.338716018222278e-09 ] [ -5.147607469924724e-09 1.87882013203666e-09 -6.493660136123637e-09 ] [ -4.280780090379017e-09 -3.800995804302815e-10 -1.039015207573261e-08 ] [ -9.354426761610738e-10 2.694908500613575e-09 1.701321729381801e-08 ] [ 1.290520936130192e-08 -3.433989051000049e-09 2.869505377429931e-09 ] [ 1.141792931207403e-09 -8.442923488082333e-09 4.828350706886985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.384114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.746548074892198e-18 } }