{ "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" [ [ 1.7282799999999996 4.775804499999999 -2.2970537999999996 ] [ 1.2087744999999999 -2.3402852999999997 -1.3606943999999999 ] [ -1.7751297999999995 4.284758299999999 0.15598429999999996 ] [ 0.05081749999999999 -2.6893898999999997 0.7460828999999999 ] [ -1.2276404999999997 0.9982145999999997 -0.5003137999999999 ] [ 2.2737639999999995 -2.8394843999999995 0.8094778999999998 ] [ -4.240714399999999 0.5838640999999999 -2.0765939999999996 ] [ 1.9818485999999995 -2.7734818999999997 4.523110899999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.769009810196223e-09 7.651682315411431e-09 -3.680285895079798e-09 ] [ 1.93667024371921e-09 -3.749550393661914e-09 -2.180072755733483e-09 ] [ -2.844071464445379e-09 6.864939574038752e-09 2.499143986718534e-10 ] [ 8.141861042750399e-11 -4.30887762199565e-09 1.195356579558664e-09 ] [ -1.966896907847222e-09 1.599316094661223e-09 -8.01591073423607e-10 ] [ 3.64297152201669e-09 -4.549355520806315e-09 1.29692656643428e-09 ] [ -6.794373467169898e-09 9.354534107444332e-10 -3.327070357693555e-09 ] [ 3.17527149288521e-09 -4.443607858391963e-09 7.246822537265645e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.553538 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.69630473703244e-18 } }