{ "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" [ [ 0.49232 0.2775699 0.3967067 ] [ -0.0491034 -0.2016215 -1.6684356 ] [ -0.6770559 0.4280803 0.3290182 ] [ -0.6005934 1.1606005 -0.6273896 ] [ 0.8480515 -0.0538806 -0.0143933 ] [ 0.3234119 -0.9916456 -1.1043374 ] [ -0.1319537 -1.1801066 1.8430986 ] [ -0.205077 0.5610036 0.8457323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.887835939522559e-10 4.447160044177939e-10 6.355942000547194e-10 ] [ -7.867231948179073e-11 -3.230332535506272e-10 -2.673128511630421e-09 ] [ -1.084763133954703e-09 6.858602484850503e-10 5.271452678576985e-10 ] [ -9.62256704086783e-10 1.85948698718879e-09 -1.005188949253064e-09 ] [ 1.358728286534371e-09 -8.632623763467648e-11 -2.306060875616064e-11 ] [ 5.181629850685075e-10 -1.588791396439189e-09 -1.769343563755058e-09 ] [ -2.11413133168057e-10 -1.890739204571777e-09 2.952969486749211e-09 ] [ -3.285695748638016e-10 8.988268521046349e-10 1.355012518515412e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.647095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.871511882923658e-18 } }