{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.21631e-10 0.0 0.0 ] "source-value" [ 5.21631 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] "source-value" [ 0.340777 5.491 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] "source-value" [ 0.0764414 0.261433 5.31631 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.974906929356749e-08 -5.719761580088691e-08 2.167698104276242e-08 ] [ 5.691249389140828e-09 -3.413843923040759e-09 4.274966272075121e-09 ] [ 2.313259134737995e-09 -6.373447222088392e-09 2.142869413510197e-09 ] [ 9.120714534234388e-09 3.293080340900946e-09 -8.096718434718063e-09 ] [ -6.629448289742666e-09 -1.462116263221609e-09 4.583618708712772e-09 ] [ -4.414306739654254e-08 4.951389011327713e-08 -2.532721619270717e-08 ] [ -8.588054734665558e-09 1.113013064611505e-08 5.370141471235417e-09 ] [ -7.513722090947588e-09 4.5099222691622e-09 -4.624642441088355e-09 ] ] "source-value" [ [ 31.050927 -35.6999441 13.5297075 ] [ 3.5521985 -2.1307538 2.6682241 ] [ 1.4438228 -3.9779929 1.3374739 ] [ 5.6927023 2.0553791 -5.0535742 ] [ -4.1377762 -0.9125812 2.8608698 ] [ -27.5519358 30.9041397 -15.8080051 ] [ -5.3602422 6.9468812 3.3517787 ] [ -4.6896965 2.8148721 -2.8864748 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.461427743840586e-18 "source-value" -9.1215146 } }