{ "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" [ [ 4.1758983 4.6198722 -6.4677072 ] [ -5.9388991 -5.212044 3.4172376 ] [ 0.3674977 0.7456313 -0.2469792 ] [ 0.6145799 1.3328251 1.2784597 ] [ -0.1113395 -1.7437591 1.7490752 ] [ -0.3156081 -0.839372 3.8243782 ] [ 3.7699243 3.5489048 -7.9910436 ] [ -2.5620535 -2.4520584 4.4365793 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.690526627098465e-09 7.401851229923861e-09 -1.036240926601983e-08 ] [ -9.515165291310161e-09 -8.350615043380914e-09 5.475018190438702e-09 ] [ 5.887962231377721e-10 1.194633036596711e-09 -3.957043000638874e-10 ] [ 9.84665547393602e-10 2.135421214835422e-09 2.048318241974982e-09 ] [ -1.783855438715616e-10 -2.793810062327249e-09 2.802327393461084e-09 ] [ -5.056599191551085e-10 -1.344822194554138e-09 6.127329341137187e-09 ] [ 6.040084575645805e-09 5.685972300004899e-09 -1.280306323171347e-08 ] [ -4.104862218938813e-09 -3.928630641316254e-09 7.10818363078523e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.827141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.579923107950513e-18 } }