{ "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" [ [ 3.095721501050546e-09 1.092746940273811e-10 -2.761631466422116e-09 ] [ 7.124083150917063e-10 2.492490147212352e-10 -9.944726307071808e-10 ] [ 1.50512477199504e-09 8.73167993522523e-10 -1.529857091837343e-09 ] [ 1.798138843290048e-10 9.457622957756469e-10 3.503594012114085e-09 ] [ 1.135804635869501e-09 1.03594657471321e-10 9.700312661392148e-10 ] [ -4.01002698148873e-10 -2.800260265184928e-09 -2.361737794930161e-09 ] [ -2.225082383106294e-09 1.085694799659698e-09 -3.838188732378068e-10 ] [ -4.002787866862969e-09 -5.664830297752148e-10 3.557892258445983e-09 ] ] "source-value" [ [ 1.9321974000000004 0.06820390000000001 -1.7236748000000004 ] [ 0.4446503000000001 0.15556900000000004 -0.6207010000000001 ] [ 0.9394250000000002 0.5449886000000002 -0.9548617000000003 ] [ 0.11223100000000003 0.5902984000000001 2.1867714000000005 ] [ 0.7089135000000001 0.06465870000000001 0.6054459000000001 ] [ -0.25028620000000007 -1.7477850000000004 -1.4740808000000003 ] [ -1.3887872000000003 0.6776374000000001 -0.23956090000000005 ] [ -2.4983437000000004 -0.3535709000000001 2.2206617000000004 ] ] } "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" -4.279572049206935e-18 "source-value" -26.710988 } }