{ "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" [ [ 1.9622051000000005 0.12538600000000003 -1.7431717000000004 ] [ 0.35123610000000005 0.28223190000000004 -0.5805295000000001 ] [ 0.7208737000000001 0.3869940000000001 -0.8942286000000003 ] [ 0.07179730000000001 0.6001289000000001 2.0706704000000005 ] [ 0.9143501000000003 0.04071170000000001 0.5342138000000001 ] [ -0.30082400000000004 -1.6784924000000006 -1.4412277000000002 ] [ -1.4511566000000002 0.6736578000000001 -0.08278210000000001 ] [ -2.2684816000000003 -0.4306179000000001 2.1370554000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.143799136434527e-09 2.008905177756289e-10 -2.792868943780192e-09 ] [ 5.62742267800971e-10 4.521853518239636e-10 -9.301107925847139e-10 ] [ 1.154966988689593e-09 6.200327391898754e-10 -1.432712156570715e-09 ] [ 1.150319554965639e-10 9.615124930464213e-10 3.317579704262585e-09 ] [ 1.464950353446142e-09 6.522733393302338e-11 8.559048608687273e-10 ] [ -4.819731797755393e-10 -2.689241281470483e-09 -2.309101326189357e-09 ] [ -2.325009177639617e-09 1.079318777579563e-09 -1.326315452407277e-10 ] [ -3.634508184234978e-09 -6.899259318779926e-10 3.423940199234393e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.485682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.083256386554339e-18 } }