{ "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" [ 5.11534 0 0 ] "si-unit" "m" "si-value" [ 5.11534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.215947 5.44617 0 ] "si-unit" "m" "si-value" [ -2.15947e-11 5.446170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.311017 -0.240161 5.43903 ] "si-unit" "m" "si-value" [ 3.11017e-11 -2.40161e-11 5.43903e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.11262 0.0410701 -0.0158461 ] [ 1.41877 1.4243 1.25044 ] [ 0.19719 2.45185 3.01922 ] [ 1.59796 4.1675 4.07229 ] [ 3.2205 -0.170535 2.05026 ] [ 3.94627 1.40202 3.6633 ] [ 2.60901 3.00439 -0.668036 ] [ 3.72698 4.31381 0.563179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1262e-11 4.10701e-12 -1.58461e-12 ] [ 1.41877e-10 1.4243e-10 1.25044e-10 ] [ 1.9719e-11 2.45185e-10 3.01922e-10 ] [ 1.59796e-10 4.1675e-10 4.07229e-10 ] [ 3.2205e-10 -1.70535e-11 2.05026e-10 ] [ 3.94627e-10 1.40202e-10 3.6633e-10 ] [ 2.60901e-10 3.00439e-10 -6.68036e-11 ] [ 3.726980000000001e-10 4.31381e-10 5.63179e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8734377000000004 2.5630049000000006 -0.16707040000000004 ] [ 2.3614437000000006 4.032745800000001 0.3877045000000001 ] [ -0.21421020000000005 2.0814089000000005 -2.7614731000000003 ] [ -0.9513140000000002 4.652712300000001 -5.722610800000001 ] [ -2.2832575000000004 -1.8129909000000004 2.9667885000000003 ] [ 1.8796976000000005 -3.893077500000001 -0.9363488000000002 ] [ -3.5451439000000007 -5.030477100000001 2.8781552000000006 ] [ 4.626222000000001 -2.5933264000000005 3.354855000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.001578083465325e-09 4.106386529775843e-09 -2.676762889077043e-10 ] [ 3.78344988747545e-09 6.461171038389393e-09 6.211710856789538e-10 ] [ -3.432025743768922e-10 3.334784677905046e-09 -4.424367639788101e-09 ] [ -1.524173049839732e-09 7.454466870368597e-09 -9.168633233697588e-09 ] [ -3.658181785766257e-09 -2.904731633703152e-09 4.753319173558301e-09 ] [ 3.011607548893871e-09 -6.237397753462514e-09 -1.500196156274135e-09 ] [ -5.679946673951735e-09 -8.059712801089784e-09 4.611312972473949e-09 ] [ 7.41202473103062e-09 -4.15496692818343e-09 5.375070247173986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -213.89198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.426927297326212e-17 } }