{ "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" [ [ -5.4230331 6.1263961 5.0799498 ] [ -3.7135643 -3.292237 2.9355299 ] [ 0.8061528 0.07865530000000004 -3.5155073 ] [ 4.909284 -4.5511647 -3.3181361 ] [ -3.9301234 -1.9018889 -3.1026267 ] [ 4.0656421 3.0261426 6.7845185 ] [ 0.8337485 2.3740074 -3.6054027 ] [ 2.4518934 -1.8599108 -1.2583255 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.688656846644548e-09 9.815568601180299e-09 8.138976804397635e-09 ] [ -5.949785901297518e-09 -5.274745151532729e-09 4.703237375439363e-09 ] [ 1.291599168952458e-09 1.260196827620103e-10 -5.632463606311731e-09 ] [ 7.865540049667509e-09 -7.291769679750246e-09 -5.31624008405249e-09 ] [ -6.296751828339006e-09 -3.047161930939029e-09 -4.970955961809856e-09 ] [ 6.513876721160215e-09 4.848414924926926e-09 1.086999692408509e-08 ] [ 1.335812354327069e-09 3.803579153886194e-09 -5.776491914509197e-09 ] [ 3.928366282173823e-09 -2.979905600533425e-09 -2.01605969745647e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.64535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.666879061503328e-18 } }