{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.474350000000001e-10 0.0 0.0 ] "source-value" [ 5.47435 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.16605e-11 5.34737e-10 0.0 ] "source-value" [ -0.716605 5.34737 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.76149e-11 -1.65536e-11 5.698150000000001e-10 ] "source-value" [ -0.276149 -0.165536 5.69815 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.974129833358217e-09 -7.173856690254159e-09 -6.325516666518202e-09 ] [ -2.086076417962051e-09 -3.323875297076356e-09 1.794883685027802e-08 ] [ 1.862629175977503e-09 -1.720776463413423e-09 3.546609250029323e-09 ] [ -3.187218218988803e-08 -4.740291843411044e-08 3.163399059711525e-08 ] [ 2.618230266175799e-08 4.117503873129911e-08 -3.63135300179387e-08 ] [ 3.674290550164766e-09 5.210049259584826e-09 3.110380135389569e-09 ] [ 1.136186514667069e-08 1.337337001621188e-08 -9.543632765508535e-09 ] [ -2.148698933144978e-09 -1.370311222414445e-10 -4.057137382846733e-09 ] ] "source-value" [ [ -4.3529095 -4.4775692 -3.948077 ] [ -1.3020265 -2.0745998 11.2027829 ] [ 1.1625617 -1.0740242 2.2136194 ] [ -19.8930516 -29.5865748 19.7443841 ] [ 16.3417081 25.699438 -22.6651229 ] [ 2.2933118 3.251857 1.9413466 ] [ 7.0915185 8.3470011 -5.9566671 ] [ -1.3411124 -0.0855281 -2.532266 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.69074e-11 4.07786e-12 -1.11283e-11 ] [ 1.40941e-10 1.27172e-10 1.01322e-10 ] [ -3.06599e-11 2.71071e-10 2.41068e-10 ] [ 1.07784e-10 4.29368e-10 3.98414e-10 ] [ 2.55814e-10 1.58673e-11 3.18004e-10 ] [ 3.994e-10 1.24784e-10 4.28471e-10 ] [ 2.16355e-10 2.62993e-10 -1.60126e-11 ] [ 3.70597e-10 4.39593e-10 1.80666e-10 ] ] "source-value" [ [ 0.269074 0.0407786 -0.111283 ] [ 1.40941 1.27172 1.01322 ] [ -0.306599 2.71071 2.41068 ] [ 1.07784 4.29368 3.98414 ] [ 2.55814 0.158673 3.18004 ] [ 3.994 1.24784 4.28471 ] [ 2.16355 2.62993 -0.160126 ] [ 3.70597 4.39593 1.80666 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.27913787951142e-18 "source-value" -20.466769 } }