{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4260071999999999 4.302998499999999 -2.1791852999999994 ] [ 0.36006199999999994 -8.781418699999998 0.4616257999999999 ] [ -1.8323044999999998 6.093336899999999 0.7712035999999999 ] [ 0.15524589999999996 -2.3350534999999994 0.5011604999999999 ] [ -0.7142559999999999 0.12046329999999998 -2.1023431999999995 ] [ -1.1819683999999997 -1.0659696999999997 4.809790099999999 ] [ 5.446163799999999 5.175139599999999 -5.070286099999999 ] [ -2.6589500999999998 -3.5094963999999997 2.8080346999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.825387761324696e-10 6.894163596037468e-09 -3.491439740051033e-09 ] [ 5.768829184384895e-10 -1.406938373859593e-08 7.396060643180965e-10 ] [ -2.935675432086633e-09 9.762601923837946e-09 1.235604377796795e-09 ] [ 2.487313514550547e-10 -3.741168126017212e-09 8.029476363684383e-10 ] [ -1.144364264466125e-09 1.930034829244166e-10 -3.368325123937858e-09 ] [ -1.893722137004382e-09 -1.707871731821189e-09 7.706133249175293e-09 ] [ 8.725716313407286e-09 8.291487676496261e-09 -8.12349385018721e-09 ] [ -4.260107686093822e-09 -5.622833082861766e-09 4.498967546735141e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.778729038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.726942766786483e-18 } }