{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6696173999999999 -0.12126429999999999 0.28826659999999993 ] [ 1.1679980999999997 0.9376595999999999 -1.9102471999999997 ] [ -2.2378180999999997 0.5251556999999999 -1.1473391999999998 ] [ 0.48418009999999995 1.3449730999999998 0.11214969999999999 ] [ 0.032253199999999996 0.21107309999999999 1.5036570999999999 ] [ -0.46035859999999995 -0.2620296999999999 -0.28843589999999997 ] [ 0.6434360999999998 -1.6819823999999999 1.6289727999999999 ] [ 1.0399265999999998 -0.9535849999999999 -0.18702389999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.072845343160882e-09 -1.942868263976774e-10 4.618540070775052e-10 ] [ 1.87133924895882e-09 1.50229628938868e-09 -3.060553403788661e-09 ] [ -3.585379841423076e-09 8.413921848198584e-10 -1.838240042367375e-09 ] [ 7.75742036476606e-10 2.1548844564249e-09 1.796836273697337e-10 ] [ 5.167532298598655e-11 3.381763860997805e-10 2.409124251319927e-09 ] [ -7.375757861042188e-10 -4.198178592952377e-10 -4.621252555794067e-10 ] [ 1.030898276398731e-09 -2.694832877877074e-09 2.609902136079114e-09 ] [ 1.666146085868033e-09 -1.527811592945568e-09 -2.996453201108371e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.979016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.681644220418914e-18 } }