{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5114580999999999 -0.06892199999999998 0.28936909999999993 ] [ 0.8445662999999999 0.7956433999999999 -1.7921681999999999 ] [ -2.0930731999999996 0.26508299999999996 -1.1079592999999999 ] [ 0.2603135999999999 1.5936900999999999 0.10551189999999999 ] [ 0.10816169999999999 0.20085799999999998 1.4078292999999997 ] [ -0.5403938999999999 -0.20851449999999996 -0.24178389999999997 ] [ 0.9264387999999999 -1.6946261999999999 1.6219083999999997 ] [ 1.0054447999999998 -0.8832118999999999 -0.28270729999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.194462103387883e-10 -1.104252170587776e-10 4.636204068019372e-10 ] [ 1.353144380575559e-09 1.274761253973822e-09 -2.871369990581218e-09 ] [ -3.353472946663042e-09 4.247097851715263e-10 -1.775146487257933e-09 ] [ 4.170683639962828e-10 2.553373019020414e-09 1.690486993961875e-10 ] [ 1.732941470059834e-10 3.218099917006464e-10 2.255591190537229e-09 ] [ -8.65806472602933e-10 -3.340770569978016e-10 -3.873805118658451e-10 ] [ 1.484318585962007e-09 -2.715090478635145e-09 2.598583719559134e-09 ] [ 1.610900152064931e-09 -1.415061457392348e-09 -4.529470265894917e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.20172624065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.75602036201781e-18 } }