{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4238e-10 0.0 0.0 ] "source-value" [ 5.4238 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] "source-value" [ -0.0012341 5.50722 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] "source-value" [ -0.00966142 -0.113973 5.43239 ] } "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" [ [ 3.187418234718144e-11 -1.787051781074112e-10 1.007469487455111e-10 ] [ -8.677507139322739e-10 4.565030575993574e-10 -5.695883685016494e-10 ] [ 1.860834898379869e-09 4.202940261869395e-10 2.479680745129056e-09 ] [ -2.259474386013062e-10 5.216672657735212e-10 -2.052525397563541e-09 ] [ 2.43815232711792e-10 -4.315403287372169e-09 -3.066277660419456e-11 ] [ 5.877351015618163e-10 7.270967499158765e-10 3.812582745624442e-10 ] [ -6.30582751802519e-10 -5.28550056318816e-11 -7.085288046221012e-10 ] [ -9.99978670882222e-10 2.421402211418104e-09 3.996193788544743e-10 ] ] "source-value" [ [ 0.0198943 -0.111539 0.0628813 ] [ -0.5416074 0.2849268 -0.3555091 ] [ 1.1614418 0.2623269 1.547695 ] [ -0.1410253 0.3255991 -1.2810856 ] [ 0.1521775 -2.6934629 -0.0191382 ] [ 0.3668354 0.4538181 0.2379627 ] [ -0.3935788 -0.0329895 -0.4422289 ] [ -0.6241376 1.5113204 0.2494228 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.852094784020859e-18 "source-value" -36.525903 } }