{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.708977 -0.8036835 -1.9092137 ] [ 0.756637 -1.2289466 0.3239994 ] [ -0.2477107 -3.0791217 0.5143627 ] [ 0.0649831 0.7191921 2.0774813 ] [ -0.6555904 1.9828179 0.0100922 ] [ -1.1254823 1.5642129 0.7468717 ] [ 0.2316288 1.0062523 -1.6112955 ] [ -0.7334426 -0.1607234 -0.152298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.738082994884922e-09 -1.287642914222717e-09 -3.058897554251065e-09 ] [ 1.21226611183225e-09 -1.968989510731649e-09 5.191042638332275e-10 ] [ -3.968762922620026e-10 -4.933296800337952e-09 8.240998925515641e-10 ] [ 1.041144035671085e-10 1.152272768484056e-09 3.328491969009191e-09 ] [ -1.05037161170092e-09 3.176824482683753e-09 1.616948689243776e-11 ] [ -1.803221428184212e-09 2.506145338333769e-09 1.196620376477151e-09 ] [ 3.711102480639591e-10 1.612193909686228e-09 -2.581579979300246e-09 ] [ -1.175104586418766e-09 -2.575072738954867e-10 -2.440082949945984e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -218.00589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.492839401546965e-17 } }