{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4674927 -1.4565907 0.3186044 ] [ 2.1885357 0.0543885 3.8136973 ] [ 0.4528094 0.661901 -1.1139725 ] [ 1.426281 0.174216 -2.8128709 ] [ -2.2942679 -0.676802 -1.9400219 ] [ -0.5050425 1.2474512 2.8859517 ] [ 0.7992262 -1.6389214 -2.0125238 ] [ 1.3999508 1.6343573 0.8611357 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.555535782505571e-09 -2.333715584841703e-09 5.104605251695896e-10 ] [ 3.506420761214833e-09 8.713998385830899e-11 6.110216703208888e-09 ] [ 7.254806403355595e-10 1.060482316221234e-09 -1.784780710418565e-09 ] [ 2.285154091718154e-09 2.79124804468944e-10 -4.506716030438551e-09 ] [ -3.675822421516248e-09 -1.084356350244468e-09 -3.108257757628285e-09 ] [ -8.091672926769449e-10 1.998637164695261e-09 4.623804380592577e-09 ] [ 1.280501542920611e-09 -2.625841572042568e-09 -3.224418607728889e-09 ] [ 2.242968460509607e-09 2.618529077667328e-09 1.379691497243234e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.804521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.736516693776231e-18 } }