{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4832789 0.3089151 0.4030322 ] [ -0.0580553 -0.1943617 -1.6906046 ] [ -0.7052913 0.4312302 0.2572129 ] [ -0.5393161 1.1449994 -0.5357272 ] [ 0.8485109 -0.0283962 -0.0936552 ] [ 0.354705 -1.040189 -1.0782824 ] [ -0.178369 -1.2064331 1.8253809 ] [ -0.205463 0.5842353 0.9126434 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.742981612852225e-10 4.949365551097734e-10 6.457287735896148e-10 ] [ -9.301484513986019e-11 -3.114017742845177e-10 -2.708647187452916e-09 ] [ -1.130001241023484e-09 6.909069503151468e-10 4.121004983433786e-10 ] [ -8.640796537600072e-10 1.834491284624019e-09 -8.583296020382447e-10 ] [ 1.35946433767431e-09 -4.549572813439079e-11 -1.500521730925968e-10 ] [ 5.6830006296297e-10 -1.666566510743826e-09 -1.727598866133441e-09 ] [ -2.857786440299459e-10 -1.932918923304185e-09 2.924582626129891e-09 ] [ -3.291880177515419e-10 9.3604814641798e-10 1.462215930654315e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.635186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.869603899144392e-18 } }