{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7041643 4.8192238 4.5121459 ] [ -5.1092724 -4.3946712 3.5801606 ] [ -2.8261706 -6.1969888 -3.5810758 ] [ 6.0389402 -1.8832457 2.089994 ] [ 0.8926111 1.815151 -2.3434964 ] [ 1.6339107 0.6331876 0.6720592 ] [ 3.7712588 3.852188 -3.7428378 ] [ 0.3028865 1.3551554 -1.1869496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.536902061861998e-09 7.721247702762935e-09 7.229254670618575e-09 ] [ -8.185956788578706e-09 -7.041039452743082e-09 5.736049612029301e-09 ] [ -4.528024461712309e-09 -9.928670574719448e-09 -5.737515924072657e-09 ] [ 9.675448802849276e-09 -3.017292231762131e-09 3.348539524412275e-09 ] [ 1.430120635886571e-09 2.908192495421741e-09 -3.754695143008965e-09 ] [ 2.617813524014963e-09 1.014478369300462e-09 1.076757538033551e-09 ] [ 6.042222680346263e-09 6.17188555252631e-09 -5.996687218606507e-09 ] [ 4.852776690559391e-10 2.171198299430872e-09 -1.901702899187912e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.104856 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.663111983495061e-18 } }