{ "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" [ 5.36644 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] } "unrelaxed-configuration-positions" { "source-unit" "angstrom" "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] } "unrelaxed-configuration-forces" { "source-unit" "eV/angstrom" "source-value" [ [ -0.044311 2.128682 -0.67244 ] [ -1.006855 0.831529 -0.490417 ] [ 2.030419 1.959042 -1.796593 ] [ -0.494292 1.122302 -2.984042 ] [ 0.367947 -1.197887 1.481846 ] [ -2.055961 -1.711441 2.517608 ] [ 2.83843 -1.483059 1.46999 ] [ -1.635377 -1.64917 0.474047 ] ] } "unrelaxed-potential-energy" { "source-unit" "eV" "source-value" -35.051908 } }