{ "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" [ [ 7.284031807542431e-09 7.43499225332511e-09 -6.41725585786625e-09 ] [ -2.309246002738215e-10 1.106436738410237e-09 -1.106015365958966e-09 ] [ 8.433566135746214e-10 3.776634708783552e-10 -2.777627437586521e-09 ] [ 9.275210342948525e-10 3.259269447454541e-10 2.26797425342173e-09 ] [ 1.308112643165382e-09 -1.959112732735066e-10 4.876796522458425e-10 ] [ 1.173863380190632e-09 -3.903476628587357e-09 -2.949938969670968e-09 ] [ -3.888999040206484e-09 2.474071044126649e-09 2.164928021007709e-09 ] [ -7.416961838287613e-09 -7.619702709842603e-09 8.330255544189761e-09 ] ] "source-value" [ [ 4.546335100000001 4.640557200000001 -4.005336100000001 ] [ -0.14413180000000003 0.6905835000000001 -0.6903205000000001 ] [ 0.5263818000000001 0.23571900000000007 -1.7336587000000006 ] [ 0.5789131000000001 0.20342760000000004 1.4155582000000002 ] [ 0.8164597000000002 -0.12227820000000003 0.30438570000000004 ] [ 0.7326679000000001 -2.4363585000000003 -1.8412071000000005 ] [ -2.4273223000000006 1.5441937000000003 1.3512418000000002 ] [ -4.629303500000001 -4.755844400000001 5.1993366000000005 ] ] } "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" -9.998438957848805e-18 "source-value" -62.405348 } }