{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -46.5971143 66.0392551 -14.6036903 ] [ 2.6333337 -6.7116314 5.7251802 ] [ 0.1126959 -5.5866879 2.3859324 ] [ 2.3097138 2.6134117 -1.1359893 ] [ -4.3618947 4.2742612 0.5695115 ] [ 47.4824753 -61.9559113 10.5150986 ] [ 3.8792069 2.595479 -2.2763207 ] [ -5.4584167 -1.2681764 -1.1797224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.465680712820535e-08 1.058065505762672e-07 -2.339769117606374e-08 ] [ 4.219065688904761e-09 -1.075321891650717e-08 9.172749866307068e-09 ] [ 1.805587362400147e-10 -8.950860741086248e-09 3.822685110089234e-09 ] [ 3.700569451099127e-09 4.187147126265183e-09 -1.820055497938958e-09 ] [ -6.988525710731429e-09 6.848121365832553e-09 9.124580105767392e-10 ] [ 7.607531182337345e-08 -9.926431260521853e-08 1.684704514232681e-08 ] [ 6.215174602426043e-09 4.158415773577363e-09 -3.647067806983091e-09 ] [ -8.745347623324288e-09 -2.031842579130309e-09 -1.890123648314066e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -221.87827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.5548817685755e-17 } }