{ "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" [ [ -1.7796997 0.3785338 -0.5308998 ] [ 0.2602264 -0.0693558 1.8859516 ] [ -0.3015206 0.3329138 -0.3118424 ] [ -0.1139206 -0.9594854 -1.5974996 ] [ -1.7270793 0.4190752 0.3598004 ] [ 3.4130561 -0.947863 -0.5254926 ] [ -1.0530321 1.9629728 1.0391631 ] [ 1.3019697 -1.1167913 -0.3191807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.851393251384774e-09 6.06478004542583e-10 -8.505952475473959e-10 ] [ 4.169286541949492e-10 -1.111202412768806e-10 3.021627561480354e-09 ] [ -4.830892560095885e-10 5.33386707101687e-10 -4.996266026541619e-10 ] [ -1.825209219475085e-10 -1.537265075878936e-09 -2.559476510857352e-09 ] [ -2.767086076727629e-09 6.714324877970842e-10 5.764637890344883e-10 ] [ 5.468318688898826e-09 -1.51864393832135e-09 -8.419319581234061e-10 ] [ -1.687143411571928e-09 3.145029127426314e-09 1.664922824018052e-09 ] [ 2.08598541432999e-09 -1.789296911172839e-09 -5.113838553505785e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.703592 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.637516431058192e-18 } }