{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9781429999999998 1.7763254999999996 -0.8545965999999998 ] [ 0.3736112999999999 -0.6912072999999999 -0.6445745999999999 ] [ -0.7347273999999999 1.6583443999999996 0.09580739999999997 ] [ -0.26277539999999994 -0.9621566999999998 0.28422659999999994 ] [ -0.34628619999999993 0.13149929999999999 -0.039613699999999995 ] [ 0.8699361999999998 -0.9772775999999997 0.35177099999999994 ] [ -1.5854314999999997 0.06624499999999998 -0.8657004999999998 ] [ 0.7075300999999999 -1.0017725999999998 1.6726805999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.567157846399174e-09 2.84598718703087e-09 -1.369214692735169e-09 ] [ 5.985912901266949e-10 -1.107436176186292e-09 -1.032722354481512e-09 ] [ -1.17716306294117e-09 2.656960626914603e-09 1.535003763796339e-10 ] [ -4.210126024013683e-10 -1.541544970286079e-09 4.553812135294732e-10 ] [ -5.548116537456729e-10 2.106851041115654e-10 -6.346814400338496e-11 ] [ 1.393791441227593e-09 -1.565771322751534e-09 5.635992720754366e-10 ] [ -2.540141283179875e-09 1.06136190244896e-10 -1.38700510171487e-09 ] [ 1.133588184732286e-09 -1.60501663907803e-09 2.679929751385716e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.394807240654238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.786955348429878e-18 } }