{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.5612e-10 0.0 0.0 ] "source-value" [ 5.5612 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] "source-value" [ -0.0917257 5.43287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] "source-value" [ -0.0143429 0.0662566 5.45634 ] } "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" [ [ -1.443077278001318e-10 -1.474654577020666e-10 -2.613505751734617e-10 ] [ 4.589136925430132e-10 8.861882420491161e-10 -1.689412574319967e-09 ] [ -2.069362191018542e-09 4.894636759131034e-10 -1.727059078596566e-09 ] [ -1.13217810908832e-10 2.015045840090828e-09 1.03466483341657e-10 ] [ 1.603985478204883e-09 6.427306151590866e-10 5.761246082438649e-10 ] [ -1.659357503308041e-09 -7.929845010519935e-11 9.385116454782164e-10 ] [ 7.524377366564218e-10 -1.806164947071946e-09 1.699672272528922e-09 ] [ 1.170908325631229e-09 -2.000499678550585e-09 3.600470582796729e-10 ] ] "source-value" [ [ -0.09006979999999999 -0.09204069999999999 -0.16312219999999997 ] [ 0.28643139999999995 0.5531151999999999 -1.0544483999999998 ] [ -1.2915942999999999 0.30549919999999997 -1.0779454999999998 ] [ -0.07066499999999999 1.2576926999999998 0.06457869999999999 ] [ 1.0011289999999997 0.40116089999999993 0.35958869999999993 ] [ -1.0356894999999997 -0.049494199999999995 0.5857728999999999 ] [ 0.46963469999999996 -1.1273194999999998 1.0608519999999997 ] [ 0.7308234999999998 -1.2486136999999997 0.22472369999999997 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.015286715470954e-16 "source-value" 633.69213 } }