{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 902.5884948 -1159.4124765 309.4193542 ] [ -0.6967536 -15.9296884 -7.1823961 ] [ 28.8106024 -47.8080225 38.9456464 ] [ 8.9886465 -10.1740459 -30.5510292 ] [ -6.2215908 5.9557691 7.2512039 ] [ -743.1517571 1037.1785977 -299.0928641 ] [ -148.8600508 141.9000496 40.4466146 ] [ -41.4575913 48.289817 -59.2365298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44610619648579e-06 -1.857583579016374e-06 4.957444594066097e-07 ] [ -1.116322337575382e-09 -2.552217454138084e-08 -1.150746720755273e-08 ] [ 4.615967397674432e-08 -7.659689656724625e-08 6.239780465810621e-08 ] [ 1.440139939358588e-08 -1.63006186142235e-08 -4.894814512889171e-08 ] [ -9.968087406069367e-09 9.542194089519209e-09 1.161770945694967e-08 ] [ -1.190660380741663e-06 1.661743314519826e-06 -4.791995982571573e-07 ] [ -2.38500095127813e-07 2.27348943832561e-07 6.480262083652324e-08 ] [ -6.642238408278167e-08 7.736881645753597e-08 -9.490738392480468e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 336.03403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.383858710948549e-17 } }