{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6875273 0.3834149 -0.04083219999999999 ] [ -0.876988 0.7035305 -1.9432956999999995 ] [ -1.1617134 0.0932973 -0.4663953999999999 ] [ 1.4590584 0.1856008 0.36838329999999997 ] [ -0.3965229 -2.318843 0.5211073999999999 ] [ 1.111719 1.1423822 2.1810571999999997 ] [ -1.6959181 -2.6440417 -3.2280610999999992 ] [ 3.2478922 2.454659 2.6080364999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.703716787021748e-09 6.142983888463699e-10 -6.542039621582975e-11 ] [ -1.40508967032215e-09 1.127180119119734e-09 -3.11350293784117e-09 ] [ -1.861270049550079e-09 1.494787528437638e-10 -7.472478059286641e-10 ] [ 2.337669256861855e-09 2.973652625617767e-10 5.902151107531527e-10 ] [ -6.352997199918164e-10 -3.715196041905735e-09 8.349060932058737e-10 ] [ 1.781170190699155e-09 1.83029805285807e-09 3.494438854467509e-09 ] [ -2.717160330611557e-09 -4.236221796160287e-09 -5.17192402493393e-09 ] [ 5.203696949718678e-09 3.932797261836307e-09 4.178535106493059e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.777508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.732188686808497e-18 } }