{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42356e-10 0.0 0.0 ] "source-value" [ 5.42356 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] "source-value" [ 0.0141122 5.36968 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] "source-value" [ -0.125956 0.0899535 5.38067 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.191850335904263e-09 -1.017832686273769e-09 1.056244390104463e-09 ] [ -8.750713793480333e-10 3.813414115072975e-09 -1.167337875031776e-10 ] [ 2.956389172528646e-10 -1.011961830482172e-09 -1.744374121772876e-09 ] [ -9.27327972012046e-10 -1.583702883491528e-09 -1.813354554440123e-09 ] [ 1.077550935896172e-09 -1.100162774980846e-09 -6.359292151861287e-10 ] [ -2.83456398815989e-09 4.096727487582025e-09 -1.620921446392712e-09 ] [ 1.111923872901153e-09 -1.70763605164027e-09 6.802995740872396e-10 ] [ -1.040001042869806e-09 -1.488845375786415e-09 4.194769161103315e-09 ] ] "source-value" [ [ 1.9921963 -0.6352812 0.6592559 ] [ -0.5461766 2.3801459 -0.0728595 ] [ 0.1845233 -0.6316169 -1.0887527 ] [ -0.5787926 -0.9884696 -1.1318069 ] [ 0.6725544 -0.6866676 -0.3969158 ] [ -1.7691957 2.5569762 -1.0116996 ] [ 0.6940083 -1.0658226 0.4246096 ] [ -0.6491176 -0.9292642 2.618169 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.774684178627948e-18 "source-value" -36.042744 } }