{ "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" [ 5.44972 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0609808 5.45304 0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0674249 -0.145247 5.63878 ] } "unrelaxed-configuration-positions" { "source-unit" "angstrom" "source-value" [ [ -0.00897115 -0.00389651 -0.0378043 ] [ 1.32076 1.2724 1.76049 ] [ 0.246678 2.71711 2.69984 ] [ 1.36622 4.37217 4.08545 ] [ 2.70002 -0.0778066 3.30264 ] [ 4.02111 1.29847 4.36135 ] [ 2.82584 3.00896 0.436415 ] [ 4.07612 3.84466 1.60166 ] ] } "unrelaxed-configuration-forces" { "source-unit" "eV/angstrom" "source-value" [ [ -0.100897 0.184545 1.755794 ] [ 3.070629 -3.186542 -3.746033 ] [ -2.875379 2.454705 3.983538 ] [ -9.642083 -9.451259 7.273786 ] [ 9.407105 6.768261 -8.452318 ] [ 1.398189 2.717339 1.34985 ] [ -6.588918 -5.304439 -6.78575 ] [ 5.331355 5.817391 4.621133 ] ] } "unrelaxed-potential-energy" { "source-unit" "eV" "source-value" -28.652081 } }