{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7911593 10.0331951 8.8224727 ] [ -5.9188854 -5.1221349 4.3877425 ] [ 1.2177264 -0.5794186999999998 -6.8637198 ] [ 6.8622902 -6.6388721 -5.144963 ] [ -5.2890922 -2.4177768 -5.3654452 ] [ 6.3170919 5.3707293 12.2923927 ] [ 0.7664436 3.6370443 -5.3573125 ] [ 3.8355847 -4.2827663 -2.7711674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.248281327938849e-08 1.607495062114512e-08 1.413515949758625e-08 ] [ -9.483099809074456e-09 -8.206564785363746e-09 7.029938451590544e-09 ] [ 1.951012768610949e-09 -9.283310947943287e-10 -1.099689139528205e-08 ] [ 1.099460092358496e-08 -1.06366456671014e-08 -8.24313943348103e-09 ] [ -8.474059868095637e-09 -3.873705463272637e-09 -8.59639085962358e-09 ] [ 1.012109695362505e-08 8.604856921105549e-09 1.969458419763259e-08 ] [ 1.227978017081787e-09 5.827187346273902e-09 -8.5833608378196e-09 ] [ 6.145284133438183e-09 -6.861748038210118e-09 -4.439899620603123e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.568607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.936324774102322e-18 } }