{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] "source-value" [ 5.42386 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] "source-value" [ -0.00583756 5.42008 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] "source-value" [ 0.133978 0.025245 5.31918 ] } "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" [ [ 2.219478449939722e-09 2.384805773698777e-09 1.401534440400595e-10 ] [ -1.148593850527375e-09 -8.680495198720532e-10 5.247126830943379e-10 ] [ 1.11517581078839e-10 6.986015580619622e-10 -1.395184533799379e-09 ] [ 4.994500427905498e-10 -6.362208113311142e-10 -8.422070518491974e-10 ] [ 2.590413580099027e-10 8.357497994143873e-10 -4.60135031781049e-10 ] [ 4.882027629125338e-10 5.500801057491263e-11 -1.166826940907403e-09 ] [ -5.56179752362174e-10 8.040850215515443e-10 4.17885634290553e-10 ] [ -1.872916591841998e-09 -3.273979832098416e-09 2.781601636694415e-09 ] ] "source-value" [ [ 1.3852895000000003 1.4884787000000002 0.08747690000000001 ] [ -0.7168959000000001 -0.5417939000000002 0.32749990000000007 ] [ 0.06960380000000001 0.4360328000000001 -0.8708057000000002 ] [ 0.31173220000000007 -0.3970978000000001 -0.5256643000000001 ] [ 0.16168090000000002 0.5216340000000002 -0.28719370000000005 ] [ 0.30471220000000004 0.034333300000000004 -0.7282761000000001 ] [ -0.34714010000000006 0.5018704000000002 0.26082370000000005 ] [ -1.1689826000000003 -2.0434575000000006 1.7361392000000004 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.438607465158447e-18 "source-value" -27.703609 } }