{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.691865 0.734737 -0.4965221 ] [ -0.2747368 -1.358979 2.3364645 ] [ -0.1090819 1.0563631 -1.5593345 ] [ 1.5193221 -0.4103846 -0.990702 ] [ -0.0831834 0.5680041 0.5381998 ] [ -1.7686931 -1.3469422 1.424326 ] [ 0.286705 -0.2232746 -3.5528839 ] [ 2.1215331 0.9804762 2.3004521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.710666548549792e-09 1.17717844383673e-09 -7.955161003305197e-10 ] [ -4.401768778334054e-10 -2.177324381958163e-09 3.743428797229162e-09 ] [ -1.747684699324435e-10 1.692480261895813e-09 -2.498329279906857e-09 ] [ 2.43422234808476e-09 -6.575086116563596e-10 -1.587279582579801e-09 ] [ -1.332744987186547e-10 9.100428895385453e-10 8.622911368792359e-10 ] [ -2.833758734190276e-09 -2.158039302408918e-09 2.282021817597581e-09 ] [ 4.59352048066464e-10 -3.577253441384717e-10 -5.692347520996725e-09 ] [ 3.399070733073349e-09 1.570896044890825e-09 3.685730571890264e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.816208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.738389110330993e-18 } }