{ "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" [ 5.42356 0 0 ] "si-unit" "m" "si-value" [ 5.42356e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0141122 5.36968 0 ] "si-unit" "m" "si-value" [ 1.41122e-12 5.36968e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.125956 0.0899535 5.38067 ] "si-unit" "m" "si-value" [ -1.25956e-11 8.99535e-12 5.380670000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0132742 0.0797855 -0.0480858 ] [ 1.38077 1.28242 1.3281 ] [ 0.0139699 2.87381 2.72647 ] [ 1.34708 4.2887 4.09361 ] [ 2.73598 0.0766444 2.67003 ] [ 4.1072 1.37855 3.98819 ] [ 2.71459 2.70679 -0.0921964 ] [ 4.08895 4.12737 1.11939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.32742e-12 7.97855e-12 -4.80858e-12 ] [ 1.38077e-10 1.28242e-10 1.3281e-10 ] [ 1.39699e-12 2.873810000000001e-10 2.72647e-10 ] [ 1.34708e-10 4.2887e-10 4.09361e-10 ] [ 2.73598e-10 7.66444e-12 2.67003e-10 ] [ 4.1072e-10 1.37855e-10 3.98819e-10 ] [ 2.71459e-10 2.70679e-10 -9.21964e-12 ] [ 4.08895e-10 4.12737e-10 1.11939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.2154319 -1.8244781 1.4816598 ] [ -1.772648 4.743128 -0.5873855 ] [ 0.4899558 -0.9878289 -1.9721842 ] [ -1.6109272 -0.7400957 -1.6885558 ] [ 2.2122353 -2.2488986 -0.4519744 ] [ -4.3261489 5.649166 -2.4658371 ] [ 1.500833 -2.9600211 0.3929975 ] [ -1.7087318 -1.6309716 5.2912796 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.356043057554523e-09 -2.923136156981604e-09 2.373880691539204e-09 ] [ -2.840095182507878e-09 7.599328791061862e-09 -9.410953154969185e-10 ] [ 7.849957279853607e-10 -1.582676368930581e-09 -3.159787417151152e-09 ] [ -2.580989897650806e-09 -1.185764027694611e-09 -2.705364625676241e-09 ] [ 3.544391677368475e-09 -3.603132759469851e-09 -7.241428168801075e-10 ] [ -6.931254625679636e-09 9.050961692218254e-09 -3.950706552321271e-09 ] [ 2.404599544325127e-09 -4.742476603494699e-09 6.29651406532848e-10 ] [ -2.737690141177502e-09 -2.613104566708769e-09 8.477564469235977e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.229598 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.644403827578245e-18 } }