{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.3225597 18.1153079 21.3109208 ] [ -12.2127611 -12.1825595 8.1814159 ] [ 2.9167135 0.28158810000000006 -2.9133282 ] [ 21.5330821 -19.0507059 -14.3514302 ] [ -12.6663152 -7.9950984 -6.9306431 ] [ 7.90891 11.3789535 9.9477968 ] [ 5.2741216 9.2255232 -12.5047006 ] [ 4.5688088 0.22699100000000003 -2.7400314 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.775380016375226e-08 2.902392279597355e-08 3.414385907348044e-08 ] [ -1.956700030983569e-08 -1.951861201240494e-08 1.310807328002139e-08 ] [ 4.673090179271741e-09 4.511538705154926e-10 -4.667666330757347e-09 ] [ 3.449980071438697e-08 -3.052259560271662e-08 -2.299352594148307e-08 ] [ -2.029367408512367e-08 -1.280955973747549e-08 -1.110411434192884e-08 ] [ 1.267147069801133e-08 1.823109326687033e-08 1.593812746142905e-08 ] [ 8.45007432277629e-09 1.4780917585688e-08 -2.003473895142373e-08 ] [ 7.320038644265304e-09 3.636796733320129e-10 -4.390014249337893e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.642212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.948117595119721e-18 } }