{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1081867 -0.3279498 0.0096463 ] [ -0.5392661 0.248332 -0.3861447 ] [ 1.1030919 0.259739 1.4230116 ] [ -0.1950534 0.3721434 -1.2091232 ] [ 0.1152769 -2.47718 0.1281845 ] [ 0.3520883 0.3702694 0.1445271 ] [ -0.2922459 0.0134459 -0.3875749 ] [ -0.6520783 1.5412001 0.2774733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.733342028495678e-10 -5.254335066849732e-10 1.54550764645542e-11 ] [ -8.639995449283073e-10 3.97871727874488e-10 -6.186720156829397e-10 ] [ 1.767348067334664e-09 4.16147756738526e-10 2.279915935430954e-09 ] [ -3.125099998622555e-10 5.962394599773155e-10 -1.937228938667308e-09 ] [ 1.846939556199546e-10 -3.96887991421212e-09 2.05374210740973e-10 ] [ 5.641076473647821e-10 5.932369809651996e-10 2.315579425997814e-10 ] [ -4.682295523623006e-10 2.15427068031006e-11 -6.209634487048865e-10 ] [ -1.044744615798442e-09 2.469274788538463e-09 4.445612378188721e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.295047074190162 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.212931001219754e-18 } }