{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8735083 1.2270243 -2.7487135 ] [ -2.2780399 -2.2118609 0.9298671 ] [ 0.1209625 0.0402846 0.7114306 ] [ -0.0295577 1.00996 0.448822 ] [ 0.1824751 -0.683659 1.609718 ] [ -0.5016365 -0.1606537 1.1371953 ] [ 1.2889913 1.0924831 -3.5355763 ] [ -0.656703 -0.3135785 1.4472568 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.001691197134752e-09 1.965909646613486e-09 -4.403924506977341e-09 ] [ -3.64982226902957e-09 -3.543791822441647e-09 1.489811328071096e-09 ] [ 1.9380328949352e-10 6.454304429827968e-11 1.139837474641717e-09 ] [ -4.735665590462016e-11 1.618134299943168e-09 7.190921153006976e-10 ] [ 2.923573390981421e-10 -1.095342466399507e-09 2.579052545680935e-09 ] [ -8.037102724399393e-10 -2.57395602185017e-10 1.821987722943642e-09 ] [ 2.065191725274599e-09 1.750350881439109e-09 -5.664617688914567e-09 ] [ -1.052154193409222e-09 -5.024081414855327e-10 2.318761009253821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.121598 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.627100320073604e-18 } }