{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4554689 2.1497454 1.1802628 ] [ -0.2870402 -0.5268963 -0.6024866 ] [ -0.8465037 1.2840397 -2.6764837 ] [ 0.3080672 2.7637405 -1.0759084 ] [ -1.6958437 -1.8282797 -0.5347537 ] [ 0.807722 -0.6784411 -0.6957962 ] [ -0.4307687 -2.6394808 1.4064395 ] [ 1.6888982 -0.5244277 2.9987263 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.297416290936826e-10 3.444271848928983e-09 1.890989480139415e-09 ] [ -4.598891014586868e-10 -8.441809404010541e-10 -9.652899528181043e-10 ] [ -1.356248448734546e-09 2.057258404468369e-09 -4.288199645421865e-09 ] [ 4.935780695418048e-10 4.428000451539477e-09 -1.723795298804326e-09 ] [ -2.717041151056106e-09 -2.92922701575653e-09 -8.567698830850457e-10 ] [ 1.294113315167748e-09 -1.086982477965257e-09 -1.114788413665991e-09 ] [ -6.901675457985557e-10 -4.228914463651627e-09 2.253364504034643e-09 ] [ 2.705913233244658e-09 -8.402258071623618e-10 4.804489209621274e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -325.22669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.210706034711614e-17 } }