{ "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" [ [ 1.8366317 2.7212717 -3.4749362 ] [ 0.4202004 0.5457124 0.6867676 ] [ 0.543143 1.5304525 -1.4232068 ] [ -0.7326695 -1.5042724 1.0560177 ] [ 0.8983557 0.4556307 0.8531755 ] [ -0.2062633 -1.7663461 -0.4419687 ] [ -1.0595193 0.4616893 0.58886 ] [ -1.6998787 -2.444138 2.1552908 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.94260837076016e-09 4.359957896584671e-09 -5.567461538411594e-09 ] [ 6.732352569308083e-10 8.743276489606579e-10 1.100322992642926e-09 ] [ 8.702110163511745e-10 2.452055214744912e-09 -2.280228661523581e-09 ] [ -1.173865943673225e-09 -2.410110070594706e-09 1.691926870090988e-09 ] [ 1.439324499702418e-09 7.300008552587385e-10 1.36693783953935e-09 ] [ -3.304702369890567e-10 -2.829998425661259e-09 -7.08111918265369e-10 ] [ -1.697537051746382e-09 7.397078025335175e-10 9.43457724924288e-10 ] [ -2.723505911335897e-09 -3.915940761608871e-09 3.453156530785329e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.704632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.720512664466754e-18 } }