{ "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" [ [ 2.4482626000000005 0.23241350000000005 -2.0828266000000006 ] [ 0.4101269000000001 0.39410050000000013 -0.5543105000000002 ] [ 0.8073819000000002 0.31025630000000004 -0.9453803000000002 ] [ 0.18186480000000002 0.7585943000000003 2.1976403000000007 ] [ 1.1275924000000002 -0.003689800000000001 0.5940532000000001 ] [ -0.5216413000000001 -1.8947931000000005 -1.6633614000000005 ] [ -1.8911655000000005 0.8107326000000002 0.022610800000000004 ] [ -2.5624217000000002 -0.6076144000000001 2.4315746000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.922549099299023e-09 3.723674760583009e-10 -3.337056083700354e-09 ] [ 6.570957307411797e-10 6.314186073455906e-10 -8.881033237639587e-10 ] [ 1.293568404237084e-09 4.970853903159112e-10 -1.514666214424891e-09 ] [ 2.913795307064679e-10 1.215402052132142e-09 3.521007909587899e-09 ] [ 1.806602181071762e-09 -5.911711295427841e-12 9.517781485514267e-10 ] [ -8.357614953037192e-10 -3.035793206073157e-09 -2.664998747021158e-09 ] [ -3.029981150163543e-09 1.298936817440399e-09 3.622649513758465e-11 ] [ -4.105452140370592e-09 -9.735055861414197e-10 3.895811975851112e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.602214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.704103491951845e-18 } }