{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1906581 0.6312998 -7.3811719 ] [ 0.9344159 6.598596 -1.4762688 ] [ 2.0032118 -0.5624503 0.637448 ] [ 1.3624233 0.3883347 1.6375834 ] [ 3.0434365 -2.4617112 5.4394283 ] [ 0.8829295 -5.5731902 -3.5584175 ] [ -6.9598784 1.7787197 1.3590198 ] [ -3.4571967 -0.7995986 3.3423788 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.509821220902835e-09 1.011453788608873e-09 -1.182594114971738e-08 ] [ 1.49709932141808e-09 1.057211632840586e-08 -2.365243376863219e-09 ] [ 3.209499138913081e-09 -9.0114472844629e-10 1.021304290990032e-09 ] [ 2.182842776877172e-09 6.221807825113997e-10 2.623697859706276e-09 ] [ 4.87612284736274e-09 -3.9440961642961e-09 8.714924924578343e-09 ] [ 1.414609014369303e-09 -8.929235115277787e-09 -5.701213372516694e-09 ] [ -1.11509545479613e-08 2.849823141775489e-09 2.177389768703353e-09 ] [ -5.539039771881907e-09 -1.281098193499112e-09 5.355081215336959e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.409341 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.512984214153819e-18 } }