{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.18720849999999997 8.869724099999999 -4.458744199999999 ] [ -0.5876638999999999 -11.438880899999997 0.10266789999999999 ] [ -1.9147330999999999 7.6625952999999996 0.7042214999999998 ] [ -0.40646789999999994 -4.1483140999999994 0.9688923999999999 ] [ -1.3351624999999998 0.6285424999999999 -4.237151199999999 ] [ 0.44873969999999996 -2.3659971999999994 8.574505099999998 ] [ 7.507291499999999 6.6337871999999996 -6.636103299999999 ] [ -3.8992122999999994 -5.841456699999999 4.981711899999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.999410819150368e-10 1.421086458596632e-08 -7.143695715367598e-09 ] [ -9.415413614681491e-10 -1.832710754609566e-08 1.644921090866323e-10 ] [ -3.067740607891908e-09 1.227683104431196e-08 1.128287223164707e-09 ] [ -6.512333664856722e-10 -6.646331866754993e-09 1.552336751350802e-09 ] [ -2.13916614246888e-09 1.007036098679184e-09 -6.788664591434662e-09 ] [ 7.189602561648057e-10 -3.790745398718261e-09 1.373787160615036e-08 ] [ 1.202800692683056e-08 1.062849875920229e-08 -1.063220956047373e-08 ] [ -6.247226786595795e-09 -9.359045356155519e-09 7.981582337741147e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.105615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.02236294038058e-18 } }