{ "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" [ [ 5.118885297708942e-08 -6.338390203731628e-08 2.537296186001958e-08 ] [ 3.310165792167494e-10 -1.249542833744769e-08 7.876748076218313e-09 ] [ 4.46366710968438e-09 -1.103584992199342e-08 4.959010613578157e-09 ] [ 4.835031142525073e-09 2.348422105034692e-09 -4.434016267833883e-09 ] [ -1.137801925266756e-08 6.746058549428378e-09 -1.778850879822885e-09 ] [ -3.315633908821922e-08 5.786292717290422e-08 -2.501264515541462e-08 ] [ -6.859529183807973e-09 1.595317702686355e-08 7.377889076383176e-09 ] [ -9.424680444038537e-09 4.004595282308893e-09 -1.436109716291017e-08 ] ] "source-value" [ [ 31.9495693 -39.5611203 15.8365573 ] [ 0.2066043 -7.799033 4.9162795 ] [ 2.7860019 -6.8880358 3.095171 ] [ 3.0177891 1.4657698 -2.7674953 ] [ -7.1016011 4.2105586 -1.1102714 ] [ -20.6945593 36.1151988 -15.6116653 ] [ -4.2813814 9.95719 4.6049162 ] [ -5.8824229 2.4994718 -8.9634919 ] ] } "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" -8.134174600412113e-19 "source-value" -5.0769525 } }