{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0958727 0.3266529 -0.440876 ] [ 0.258861 -0.0186806 2.3461935 ] [ -0.2566839 0.2864414 -0.4351453 ] [ -0.0907784 -1.1624358 -1.9625432 ] [ -2.0590352 0.5774654 0.6059169 ] [ 4.2461442 -1.4658567 -1.1332326 ] [ -1.4669853 2.8795304 1.689634 ] [ 1.4643502 -1.4231171 -0.6699473 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.357958240112972e-09 5.233556394965203e-10 -7.063612198718208e-10 ] [ 4.147410422369088e-10 -2.992962058251648e-11 3.759016373572925e-09 ] [ -4.112529435157652e-10 4.589297143092212e-10 -6.971796263110023e-10 ] [ -1.454430301536307e-10 -1.862427461940945e-09 -3.144340832350019e-09 ] [ -3.298938058844252e-09 9.252015632009203e-10 9.707858913276114e-10 ] [ 6.803072965785519e-09 -2.348561334183039e-09 -1.815638777648398e-09 ] [ -2.350369550717274e-09 4.613516285762872e-09 2.707092092508788e-09 ] [ 2.346147655103804e-09 -2.280084946280695e-09 -1.073373901228084e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.580877 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.700684927696044e-18 } }