{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45804e-10 0.0 0.0 ] "source-value" [ 5.45804 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] "source-value" [ -0.0357167 5.39587 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] "source-value" [ 0.019829 -0.0610013 5.23355 ] } "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" [ [ -1.032961703646893e-08 1.152677766690261e-08 9.605271063593304e-09 ] [ -1.446508082886503e-08 -1.223308104819843e-08 1.453022997657895e-08 ] [ -6.16599370822098e-09 -1.682456468172504e-08 -1.091766632486608e-08 ] [ 1.418673420388045e-08 -4.375218949333115e-09 7.72096459815404e-09 ] [ 1.772970250753901e-10 4.696815210672548e-09 -7.901637249151794e-09 ] [ 5.195365471072856e-09 2.716357800342198e-09 1.578765135363884e-09 ] [ 1.007634639821183e-08 1.212721802906737e-08 -1.307369633757486e-08 ] [ 1.32494847531441e-09 2.365695972271847e-09 -1.542230862097444e-09 ] ] "source-value" [ [ -6.4472399 7.1944488 5.9951387 ] [ -9.0283934 -7.6352887 9.0690563 ] [ -3.8485106 -10.5010674 -6.8142714 ] [ 8.8546631 -2.7307969 4.8190471 ] [ 0.1106601 2.9315215 -4.9318141 ] [ 3.2426921 1.6954172 0.9853877 ] [ 6.2891608 7.5692142 -8.1599595 ] [ 0.8269678 1.4765513 -0.9625848 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.948525188852053e-18 "source-value" -24.644756 } }