{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] "source-value" [ 5.42386 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] "source-value" [ -0.00583756 5.42008 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] "source-value" [ 0.133978 0.025245 5.31918 ] } "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" [ [ 3.178400383607971e-09 3.500310030694431e-09 -3.912002611474944e-11 ] [ -1.561201274158364e-09 -1.203020270988937e-09 5.817347898992581e-10 ] [ -3.121296405577729e-11 9.34865572142262e-10 -1.839015495851842e-09 ] [ 6.714694980770246e-10 -9.999926098188233e-10 -9.813027388842048e-10 ] [ 2.511499972818144e-10 9.555190707433324e-10 -6.230555658203386e-10 ] [ 4.565814040361146e-10 -1.094800930701677e-10 -1.552338673962747e-09 ] [ -5.634898434122361e-10 1.319168142501888e-09 6.265252395103431e-10 ] [ -2.401697041158885e-09 -4.397369842203986e-09 3.826572311006619e-09 ] ] "source-value" [ [ 1.9838015000000004 2.1847217000000003 -0.024416800000000006 ] [ -0.9744252000000002 -0.7508662000000003 0.36309030000000003 ] [ -0.019481600000000005 0.5834972000000002 -1.1478232000000002 ] [ 0.4190983000000001 -0.6241463000000002 -0.6124810000000002 ] [ 0.15675550000000002 0.5963881000000001 -0.38888070000000013 ] [ 0.28497570000000005 -0.06833210000000002 -0.9688936000000002 ] [ -0.35170270000000003 0.8233600000000002 0.3910463000000001 ] [ -1.4990214000000002 -2.7446224000000004 2.3883586000000006 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.463145741243251e-18 "source-value" -34.098274 } }