{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1843159 -4.7565751 -0.803742 ] [ 4.5152372 -0.5187307 -0.3846911 ] [ 3.197774 -2.5262088 3.0700839 ] [ -11.9077987 10.516862 -4.5243541 ] [ -4.0885502 -2.9019588 -4.9407136 ] [ 8.8193114 -5.6673659 -3.2442539 ] [ 3.2786009 -0.8854095 16.0461604 ] [ -2.6302586 6.7393867 -5.2184897 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.897483246621711e-09 -7.620873420299423e-09 -1.287736641555033e-09 ] [ 7.234207479206453e-09 -8.310982000312186e-10 -6.163430866498348e-10 ] [ 5.123398741402099e-09 -4.047432678619223e-09 4.918816648474485e-09 ] [ -1.907839668233264e-08 1.684987042057993e-08 -7.248814363240626e-09 ] [ -6.550579543407165e-09 -4.649450543884823e-09 -7.915895819988602e-09 ] [ 1.413009453663492e-08 -9.08012114649915e-09 -5.197867750519221e-09 ] [ 5.252897710913838e-09 -1.418582400734218e-09 2.570878304648678e-08 ] [ -4.214138835578138e-09 1.079768780927046e-08 -8.360942193225607e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.474379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.761010122159848e-18 } }