{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7818963999999999 -0.8131105999999999 -0.07261609999999999 ] [ 2.2753223999999994 1.7255291999999998 -5.084516799999999 ] [ -6.377158699999999 0.5841377999999999 -2.9810109999999996 ] [ 0.9878910999999999 6.655057599999999 -0.22411539999999996 ] [ -0.12320849999999998 0.33189509999999994 5.280742699999999 ] [ -1.6194825999999998 -0.7929567999999999 -0.5053773999999999 ] [ 2.4944014999999995 -4.776868799999999 4.5102196999999995 ] [ 3.1441313999999996 -2.9136833999999996 -0.9233256999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.252736131967685e-09 -1.30274679344466e-09 -1.163438177136749e-10 ] [ 3.645468354062545e-09 2.764602542747727e-09 -8.146293945024829e-09 ] [ -1.021733457627132e-08 9.358919264855462e-10 -4.776106130547629e-09 ] [ 1.582776024316395e-09 1.066257769679736e-08 -3.590724542412403e-10 ] [ -1.974017781838368e-10 5.31754569778078e-10 8.460682494400267e-09 ] [ -2.594697159512398e-09 -1.270456846264381e-09 -8.097038549606898e-10 ] [ 3.99647176618845e-09 -7.65338751198895e-09 7.226168558011589e-09 ] [ 5.037453821803172e-09 -4.668235423893054e-09 -1.479330849923794e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.710809 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.561284666885422e-18 } }