{ "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" [ [ 0.06198980000000001 -0.9590912000000003 0.4132301000000001 ] [ -0.6761243000000001 0.4145588000000001 0.9685312000000003 ] [ -0.052060000000000016 0.25655730000000004 -1.1481388000000001 ] [ -0.32140550000000007 1.4346425000000003 -1.2865398000000001 ] [ -0.27914810000000007 -0.28722970000000003 0.5580520000000001 ] [ -1.5510956000000005 0.42691050000000014 0.005132200000000001 ] [ 0.7788785000000003 -1.8282373000000005 -0.9956087000000002 ] [ 2.0389653000000005 0.5418892000000001 1.4853418000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.931860828806786e-11 -1.536633497855017e-09 6.620676052308462e-10 ] [ -1.083270546214766e-09 6.641964173069032e-10 1.551758045155369e-09 ] [ -8.340931487884804e-11 4.110501079555719e-10 -1.839521142793367e-09 ] [ -5.149483778965345e-10 2.298550672706065e-09 -2.061263989288708e-09 ] [ -4.472445595607406e-10 -4.601927101393978e-10 8.940978675906819e-10 ] [ -2.485129106945749e-09 6.839860222740387e-10 8.222690853269762e-12 ] [ 1.247900923143773e-09 -2.929159059334517e-09 -1.595140982605081e-09 ] [ 3.266782534282459e-09 8.682022073040155e-10 2.37977990585699e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.424044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.636863483579052e-18 } }