{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.572741 0.5973011 -5.2774665 ] [ 0.3130309 0.6557645 -6.0164569 ] [ 3.3210386 13.3911727 -7.7586045 ] [ 1.313898 0.4609122 2.643176 ] [ 4.825825 -1.9207444 7.5156088 ] [ -12.3342061 -7.0834999 10.1518587 ] [ -2.5473628 -0.607957 -5.8036747 ] [ 0.5350354 -5.4929492 4.5455592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.326338723173612e-09 9.56981857998123e-10 -8.455433443355204e-09 ] [ 5.015307895679827e-10 1.050650550650602e-09 -9.639426585230844e-09 ] [ 5.320890401694363e-09 2.145502382503521e-08 -1.243065473993367e-08 ] [ 2.105096657715879e-09 7.384627510814938e-10 4.234834791859661e-09 ] [ 7.73182399107216e-09 -3.077371772212524e-09 1.204133271043874e-08 ] [ -1.976157664954875e-08 -1.134901793321914e-08 1.626507066680508e-08 ] [ -4.081325122855626e-09 -9.740544918517055e-10 -9.298511919068455e-09 ] [ 8.572212091803764e-10 -8.800674787482063e-09 7.282788678702351e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.565311 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.935796696688107e-18 } }