{ "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" [ [ 0.9379556 1.082027 -2.69094 ] [ -1.4865869 -1.4130925 0.5306272 ] [ 0.1596471 0.127352 0.4453416 ] [ 0.0606845 0.6808615 0.535741 ] [ 0.003932 -0.496423 1.0893827 ] [ 0.0245148 -0.4963623 1.6159728 ] [ 0.6849212 0.6371139 -2.4633304 ] [ -0.3850682 -0.1214766 0.9372051 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.502770533668437e-09 1.733598362474362e-09 -4.311361155975552e-09 ] [ -2.381774775967547e-09 -2.264023766527824e-09 8.501584942005657e-10 ] [ 2.557828511985197e-10 2.040403970121216e-10 7.135158997896653e-10 ] [ 9.72272871449376e-11 1.090860377302819e-09 8.583517050040128e-10 ] [ 6.2997584729856e-12 -7.953573246273985e-10 1.74538349304398e-09 ] [ 3.927703942358784e-11 -7.952600725065158e-10 2.589073840008714e-09 ] [ 1.097364733730281e-09 1.020768995366709e-09 -3.946690376185912e-09 ] [ -6.169472674535386e-10 -1.946269684942733e-10 1.501568100114526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.045342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.692270817074032e-18 } }