{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.476130000000001e-10 0.0 0.0 ] "source-value" [ 5.47613 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.68569e-12 5.44973e-10 0.0 ] "source-value" [ -0.0968569 5.44973 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.34568e-12 2.77585e-12 5.60527e-10 ] "source-value" [ -0.0334568 0.0277585 5.60527 ] } "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" [ [ 1.202560926951753e-09 -2.355015382264608e-10 -6.513556125618394e-09 ] [ 1.033544591523306e-09 1.21424880540049e-09 3.37544343444641e-09 ] [ -6.695291019715738e-10 1.586748140594682e-09 8.656034768250777e-10 ] [ -9.762334520559937e-11 -1.387119016472609e-09 1.585347037139793e-09 ] [ -2.341858628289922e-09 7.61925025516489e-10 2.886808404281585e-09 ] [ 1.175886288392054e-09 1.094595371441228e-09 1.513747526350524e-09 ] [ -3.071119438167513e-10 3.506252503780979e-09 -3.938855732510201e-09 ] [ 4.13137263439488e-12 -6.541149292034798e-09 2.254621393028659e-10 ] ] "source-value" [ [ 0.7505795 -0.1469885 -4.065442 ] [ 0.6450878 0.7578745 2.1067861 ] [ -0.4178872 0.9903703 0.5402672 ] [ -0.0609317 -0.8657716 0.9894958 ] [ -1.4616732 0.4755562 1.8018041 ] [ 0.7339305 0.6831927 0.9448069 ] [ -0.1916842 2.1884307 -2.4584404 ] [ 0.0025786 -4.0826643 0.1407224 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.098080000000001e-14 1.58858e-12 5.49688e-13 ] [ 1.34999e-10 1.33014e-10 1.19729e-10 ] [ 2.76425e-12 2.69054e-10 2.64154e-10 ] [ 1.36667e-10 4.13087e-10 4.06954e-10 ] [ 2.77416e-10 3.51576e-12 2.5647e-10 ] [ 4.07457e-10 1.31666e-10 4.03649e-10 ] [ 2.84869e-10 2.60665e-10 4.6702e-12 ] [ 4.10529e-10 4.27129e-10 1.35792e-10 ] ] "source-value" [ [ 0.000509808 0.0158858 0.00549688 ] [ 1.34999 1.33014 1.19729 ] [ 0.0276425 2.69054 2.64154 ] [ 1.36667 4.13087 4.06954 ] [ 2.77416 0.0351576 2.5647 ] [ 4.07457 1.31666 4.03649 ] [ 2.84869 2.60665 0.046702 ] [ 4.10529 4.27129 1.35792 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.695948573169636e-18 "source-value" -35.551315 } }