{ "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" [ 5.36838 0 0 ] "si-unit" "m" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0320632 5.46183 0 ] "si-unit" "m" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0835799 0.195471 5.46165 ] "si-unit" "m" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.884389200000002 3.136295000000001 -5.994177800000001 ] [ 0.03792340000000001 1.1704676000000003 -1.6044082000000004 ] [ 1.3131633000000003 0.6355519000000001 -2.7344115000000007 ] [ 0.09884190000000002 1.2891403000000001 5.110149800000001 ] [ 3.343742300000001 -0.13116110000000003 0.7407013000000001 ] [ -0.2797372000000001 -4.813631700000001 -3.536945300000001 ] [ -4.141934900000001 2.4855934000000004 0.7978833000000002 ] [ -7.2563881000000015 -3.772255400000001 7.221208500000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.103000742472802e-08 5.024898524931938e-09 -9.60373153207838e-09 ] [ 6.075998486124674e-11 1.875295824123887e-09 -2.570545308259811e-09 ] [ 2.103919538552577e-09 1.01826639548502e-09 -4.38101017694666e-09 ] [ 1.583621813354515e-10 2.065430449591098e-09 8.187362538345797e-09 ] [ 5.357265739040021e-09 -2.101432479784109e-10 1.186734305856167e-09 ] [ -4.481884018080539e-10 -7.712288170881761e-09 -5.666811068708445e-09 ] [ -6.636111261655587e-09 3.982359634294783e-09 1.278349969386753e-09 ] [ -1.162601536527133e-08 -6.043819409566554e-09 1.156965143262224e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.367156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.506225386658645e-18 } }