{ "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" [ [ 33.298019999999994 53.580217399999995 -59.840026699999996 ] [ -18.183669099999996 -135.93501499999996 50.88972679999999 ] [ -8.505337499999998 76.62227699999998 11.657682299999998 ] [ 2.1507744999999994 -29.807124199999997 -7.111206299999999 ] [ -24.447152699999997 -11.126451799999998 -35.87237569999999 ] [ -2.9993478999999996 4.712176799999999 49.21612679999999 ] [ 66.00750519999998 85.84800469999999 -85.19083559999999 ] [ -47.320792399999995 -43.894084799999995 76.25090839999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.33493091629308e-08 8.584497165566135e-08 -9.587429176678777e-08 ] [ -2.913344951238337e-08 -2.177919029810973e-07 8.153433051785918e-08 ] [ -1.362705289451352e-08 1.227624208418615e-07 1.867766603377397e-08 ] [ 3.445920620512808e-09 -4.775627752652189e-08 -1.139340847954567e-08 ] [ -3.916865650106759e-08 -1.782654094641807e-08 -5.747388167909402e-08 ] [ -4.805485083025576e-09 7.549739502036156e-09 7.88529277252883e-08 ] [ 1.057556816287744e-07 1.375436660726685e-07 -1.364907651047363e-07 ] [ -7.581626726101032e-08 -7.032607645797264e-08 1.221674227532423e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 25.726873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.121899444689076e-18 } }