{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] "source-value" [ 5.36838 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] "source-value" [ -0.0320632 5.46183 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] "source-value" [ -0.0835799 0.195471 5.46165 ] } "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" [ [ 1.950724537036867e-09 6.680871430128538e-10 -2.000892692475667e-09 ] [ 2.028668026373856e-10 1.370791875400685e-10 -8.623236610646381e-10 ] [ 1.414123062545545e-09 7.828494521841371e-10 -1.786944915893505e-09 ] [ -8.795949648192e-14 2.469138422964192e-10 2.951887536877185e-09 ] [ 6.848579267910778e-10 3.075941989796121e-10 6.956703759342086e-10 ] [ 3.482085752285818e-10 -1.956949153426337e-09 -1.747267973185365e-09 ] [ -1.054142815030959e-09 6.931519145039732e-10 -4.860912543439815e-10 ] [ -3.546550289929678e-09 -8.787267453083883e-10 3.235962423934101e-09 ] ] "source-value" [ [ 1.2175465000000003 0.4169872000000001 -1.2488590000000002 ] [ 0.12661950000000002 0.08555810000000001 -0.5382201000000001 ] [ 0.8826262000000002 0.4886162000000001 -1.1153233000000002 ] [ -5.490000000000001e-05 0.15411150000000004 1.8424233000000005 ] [ 0.42745470000000013 0.19198520000000005 0.4342033000000001 ] [ 0.21733470000000005 -1.2214316000000003 -1.0905589000000002 ] [ -0.6579442000000001 0.4326314000000001 -0.30339430000000006 ] [ -2.2135826000000005 -0.5484581000000001 2.0197289000000005 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.86347424347009e-18 "source-value" -36.596928 } }