{ "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" [ [ 1.0136942 1.0879093 -2.8680621 ] [ -1.5871271 -1.5086878 0.5673565 ] [ 0.1703464 0.1118858 0.4655844 ] [ 0.0657188 0.7003005 0.5374781 ] [ 0.0427391 -0.5056335 1.1546698 ] [ -0.0166571 -0.4715018 1.7021904 ] [ 0.7081243 0.6797235 -2.5596699 ] [ -0.3968387 -0.0939959 1.0004529 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.624117147880559e-09 1.743022846010893e-09 -4.595142043622552e-09 ] [ -2.542857933858104e-09 -2.417184321246186e-09 9.090053199589153e-10 ] [ 2.729250195174451e-10 1.792608129595047e-10 7.459484406891955e-10 ] [ 1.05293124907031e-10 1.12200508863455e-09 8.611348460120044e-10 ] [ 6.847558681403329e-11 -8.101141723932767e-10 1.849984958303812e-09 ] [ -2.668761619032768e-11 -7.554291606251175e-10 2.727209663030201e-09 ] [ 1.134540198080366e-09 1.089037100308349e-09 -4.101043270745473e-09 ] [ -6.358056873686649e-10 -1.505980334310547e-10 1.60290224659156e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.801756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.294114685958613e-18 } }