{ "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" [ [ 0.8056379 1.2917784 -4.1842261 ] [ 0.1714799 3.2936596 -0.1039834 ] [ 0.8489079 -0.5976529 0.4743144 ] [ -0.1034917 0.1387216 0.1758814 ] [ 1.5611432 -1.5357862 1.8061899 ] [ 1.5221918 -2.2439929 -1.6096245 ] [ -2.7206475 0.6775056 1.1836594 ] [ -2.0852215 -1.0242333 2.2577889 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.290774208210408e-09 2.069657151734431e-09 -6.703869233561163e-09 ] [ 2.747410867171219e-10 5.27702440799348e-09 -1.665997724312947e-10 ] [ 1.360100390592424e-09 -9.575455037333203e-10 7.599354425887796e-10 ] [ -1.658119821868474e-10 2.222565043199693e-10 2.817930671135731e-10 ] [ 2.501227136760899e-09 -2.460600744187273e-09 2.89383523050509e-09 ] [ 2.43882011433347e-09 -3.595272961621192e-09 -2.57890274216689e-09 ] [ -4.358957817937968e-09 1.085483632781076e-09 1.896431417670156e-09 ] [ -3.340893136489507e-09 -1.641002647504832e-09 3.617376590281749e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -61.924873 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.921458376660917e-18 } }