{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1989534 1.9533022 -2.8196466 ] [ 0.2738801 0.4694688 0.4063087 ] [ 0.3512652 1.525352 -1.2697044 ] [ -0.7841777 -1.2899414 0.9966436 ] [ 1.0076439 0.7427213 0.7337938 ] [ -0.2357522 -2.1190915 -0.2286801 ] [ -0.7942002 0.8625412 0.337165 ] [ -1.0176125 -2.1443526 1.8441201 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.920935122734856e-09 3.129535143980794e-09 -4.517571898657544e-09 ] [ 4.388042967375833e-10 7.521719417520192e-10 6.509783053309158e-10 ] [ 5.627888957773367e-10 2.443883333025168e-09 -2.034290721766989e-09 ] [ -1.256391187843862e-09 -2.066713970309247e-09 1.596799088345642e-09 ] [ 1.614423511972632e-09 1.189970712434104e-09 1.175667280534069e-09 ] [ -3.777166662540947e-10 -3.395158886608011e-09 -3.663859128807833e-10 ] [ -1.272449003158127e-09 1.381943356502321e-09 5.401978848026099e-10 ] [ -1.630394969966325e-09 -3.435631630777148e-09 2.954606134509743e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.882382292303475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.588773784698398e-18 } }