{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8838345 0.3849757 -0.4934536 ] [ 0.3059931 -0.0750762 1.8965194 ] [ -0.3022141 0.3156955 -0.3102644 ] [ -0.0399266 -0.9759723 -1.6131244 ] [ -1.7571142 0.4521196 0.3881954 ] [ 3.4256441 -1.0341204 -0.5889831 ] [ -1.0023797 2.1040424 1.1600971 ] [ 1.2538319 -1.1716643 -0.4389863 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.018235593356458e-09 6.167990661161145e-10 -7.90599821369595e-10 ] [ 4.902549909461165e-10 -1.202853324185049e-10 3.038559043573643e-09 ] [ -4.842003654961133e-10 5.057999493917665e-10 -4.970983679465396e-10 ] [ -6.396946506803329e-11 -1.563680001608404e-09 -2.584510200122028e-09 ] [ -2.815207291315696e-09 7.243754529254476e-10 6.219575941821044e-10 ] [ 5.488486888201457e-09 -1.656843527972344e-09 -9.436549528663085e-10 ] [ -1.605989320504518e-09 3.371047542451922e-09 1.85868045147788e-09 ] [ 2.008860156593244e-09 -1.877213148885998e-09 -7.03333586711495e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -24.886852 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.987313243970972e-18 } }