{ "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" [ [ 1.7144516 0.3276682 -2.0673634 ] [ -0.7096886 2.7496649 -0.497673 ] [ 0.4439051 -0.3231989 -2.8003363 ] [ -0.3880977 -0.2189875 3.6598499 ] [ 0.4003556 0.3844288 -0.4683684 ] [ -1.9541969 1.4282716 2.9528826 ] [ 0.6953444 -1.5831 -1.8995815 ] [ -0.2020736 -2.7647471 1.1205901 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.746854271013154e-09 5.249823294196187e-10 -3.312281306177599e-09 ] [ -1.137046482968283e-09 4.40544881781437e-09 -7.973600454033984e-10 ] [ 7.112143730738861e-10 -5.178217214482772e-10 -4.486633350237575e-09 ] [ -6.218010615262521e-10 -3.5085665274744e-10 5.863725945417218e-09 ] [ 6.414403823263564e-10 6.159228357221991e-10 -7.504089004015028e-10 ] [ -3.130968585619836e-09 2.288343365672609e-09 4.731039465687118e-09 ] [ 1.114064541084204e-09 -2.53640580838848e-09 -3.043465068604195e-09 ] [ -3.237575976008909e-10 -4.4296131660446e-09 1.795383259719934e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.914059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.754066568783183e-18 } }