{ "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" [ 5.43856 0 0 ] "si-unit" "m" "si-value" [ 5.43856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00547847 5.34673 0 ] "si-unit" "m" "si-value" [ -5.47847e-13 5.34673e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698619 0.130192 5.52638 ] "si-unit" "m" "si-value" [ -6.986190000000001e-12 1.30192e-11 5.526379999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0176967 -0.0436428 -0.0335652 ] [ 1.35227 1.24207 1.37266 ] [ -0.0530244 2.758 2.7242 ] [ 1.3158 4.14206 3.88387 ] [ 2.73162 0.0656859 2.694 ] [ 4.07939 1.42095 3.99542 ] [ 2.69114 2.74306 -0.00706676 ] [ 4.05369 4.20359 1.27338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.76967e-12 -4.36428e-12 -3.35652e-12 ] [ 1.35227e-10 1.24207e-10 1.37266e-10 ] [ -5.30244e-12 2.758e-10 2.7242e-10 ] [ 1.3158e-10 4.14206e-10 3.88387e-10 ] [ 2.73162e-10 6.568590000000001e-12 2.694e-10 ] [ 4.07939e-10 1.42095e-10 3.99542e-10 ] [ 2.69114e-10 2.74306e-10 -7.06676e-13 ] [ 4.05369e-10 4.20359e-10 1.27338e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3596927 2.601118 -3.7910605 ] [ -1.4489954 1.8089368 -1.0360147 ] [ 0.1552885 0.1409927 -2.670791 ] [ -0.6514126 -0.2475029 3.0997232 ] [ 2.0190836 0.3155938 -0.0158488 ] [ -0.8251867 -0.9231 1.7062115 ] [ -0.063866 -0.048437 -0.4630889 ] [ -2.5446041 -3.6476014 3.1708692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.382821097012429e-09 4.167450447542055e-09 -6.073948501138358e-09 ] [ -2.321546553526745e-09 2.898236249464766e-09 -1.659878531145126e-09 ] [ 2.487996041791008e-10 2.258952076434682e-10 -4.279078899243053e-09 ] [ -1.043678038214542e-09 -3.965433599602003e-10 4.966304041991363e-09 ] [ 3.234928539360699e-09 5.05637008029431e-10 -2.539257682773504e-11 ] [ -1.322094838535104e-09 -1.47896923866048e-09 2.733652175440099e-09 ] [ -1.023246120640128e-10 -7.76046289816896e-11 -7.419502089319891e-10 ] [ -4.076905198211825e-09 -5.844101685077349e-09 5.080292499854799e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -62.424493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.000150632498933e-17 } }