{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2052095 -0.4603865 0.3481185 ] [ -1.267929 1.0573109 -1.1292494 ] [ 2.2995879 -0.1082507 2.7783004 ] [ -0.3726716 0.6431074 -2.3825915 ] [ 0.3936297 -5.0658876 0.2142528 ] [ 0.641199 1.3941331 0.4897982 ] [ -0.3563347 -0.5120509 -0.5822195 ] [ -1.5426908 3.0520242 0.2635907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.287818632660576e-10 -7.376204868319392e-10 5.577473219679649e-10 ] [ -2.031446200634324e-09 1.693998804897007e-09 -1.809256987732428e-09 ] [ 3.684345970854569e-09 -1.734367407252346e-10 4.451327946439288e-09 ] [ -5.970857247561292e-10 1.030371640943474e-09 -3.817332398216803e-09 ] [ 6.306643025925177e-10 -8.116446676320621e-09 3.432708271009383e-10 ] [ 1.027314047080339e-09 2.233647459103429e-09 7.847432249499227e-10 ] [ -5.709111255197818e-10 -8.203959806395987e-10 -9.328184710738656e-10 ] [ -2.471663132883249e-09 4.889881819355823e-09 4.223188570003066e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.161422 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.793698490328278e-18 } }