{ "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" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.15024320000000002 -0.7045737000000001 0.5835987000000001 ] [ -0.4356797000000001 -0.14641240000000003 0.8455476000000002 ] [ -0.11339080000000003 0.5379230000000002 -1.2987369000000002 ] [ -0.32314820000000005 0.8473548000000002 -1.4027252000000001 ] [ -0.10365220000000003 -0.09763940000000003 1.2188683000000002 ] [ -0.9138488000000002 0.5450748000000001 -0.34697510000000004 ] [ 0.6191989000000001 -1.5399331000000005 -0.5266232000000001 ] [ 1.4207641000000002 0.5582060000000001 0.9270458000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.407161424741786e-10 -1.128851509770553e-09 9.350281930692731e-10 ] [ -6.98035829497158e-10 -2.34578524275218e-10 1.354716596493551e-09 ] [ -1.816720887738087e-10 8.618476543905987e-10 -2.080805897750268e-09 ] [ -5.177404910936027e-10 1.35761205008266e-09 -2.247413520847004e-09 ] [ -1.660691315344858e-10 -1.564355639489396e-10 1.952842294094241e-09 ] [ -1.464147182306136e-09 8.73306101147236e-10 -5.559153932197421e-10 ] [ 9.920660012050773e-10 -2.467244810416069e-09 -8.437433790108827e-10 ] [ 2.276315024691954e-09 8.94344602790285e-10 1.485291107170833e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 143.20166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.294343517117505e-17 } }