{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2045321 -0.3309605 -2.2121162 ] [ 2.039684 0.9259697 1.6894641 ] [ 0.6285125 0.8227159 -1.0623868 ] [ -1.1007823 -1.0444244 0.0087071 ] [ 0.1774349 2.0229399 -0.6904556 ] [ -0.7394782 -1.1388122 2.0693015 ] [ -0.2607776 -0.717127 -1.2595272 ] [ 0.4599388 -0.5403014 1.4570132 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.929873169623128e-09 -5.302571755082784e-10 -3.544200858132937e-09 ] [ 3.267934018619827e-09 1.48356700490919e-09 2.706819882700913e-09 ] [ 1.00698803338056e-09 1.318136180540431e-09 -1.702131293206525e-09 ] [ -1.763647665650452e-09 -1.673352355873068e-09 1.395031205496768e-11 ] [ 2.842820484939859e-10 3.24110701306349e-09 -1.106231820020437e-09 ] [ -1.184774683631267e-09 -1.824578282321814e-09 3.315386484686371e-09 ] [ -4.178117739483341e-10 -1.148964113544442e-09 -2.017985033101686e-09 ] [ 7.36903192358807e-10 -8.656582712655091e-10 2.334392485236995e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.198249 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.799598826169698e-18 } }