{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] "source-value" [ 5.43808 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] "source-value" [ -0.036104 5.43472 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] "source-value" [ 0.0778792 -0.0548884 5.50823 ] } "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" [ [ 1.680373254043075e-09 1.887352683848393e-09 -4.452245512990022e-09 ] [ -2.729522725417649e-09 -2.793523593147451e-09 1.035325571054987e-09 ] [ 2.670756328925664e-10 1.930235101321766e-10 1.228835181573915e-09 ] [ 1.6053809740416e-13 1.159196414533181e-09 7.061119211896244e-10 ] [ 2.762851043265869e-10 -7.096725985116903e-10 2.06181337565198e-09 ] [ 2.25338130832416e-11 -8.754051127381458e-10 2.400813761187838e-09 ] [ 1.227187022484098e-09 1.352386711251583e-09 -4.518657015663478e-09 ] [ -7.440929599446471e-10 -2.133580153680461e-10 1.538002717995153e-09 ] ] "source-value" [ [ 1.0488065 1.1779929 -2.7788731 ] [ -1.7036341 -1.7435803 0.6461994 ] [ 0.1666955 0.1204758 0.7669786 ] [ 0.0001002 0.7235135 0.4407204 ] [ 0.1724436 -0.4429428 1.2868827 ] [ 0.0140645 -0.5463849 1.4984701 ] [ 0.7659499 0.8440934 -2.8203239 ] [ -0.4644263 -0.1331676 0.9599458 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.781429342201516e-18 "source-value" -36.084844 } }