{ "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" [ [ 13.2548574 -13.0691998 7.4012874 ] [ 0.4908849 -3.4136842 1.7349519 ] [ 0.3666807 -3.92508 2.5149556 ] [ 3.5043962 -0.6624269 -4.4499846 ] [ -2.4759569 1.5876742 1.3231119 ] [ -5.6117402 11.3700477 -9.8343532 ] [ -4.0545524 7.9016974 3.3632901 ] [ -5.4745698 0.2109717 -2.0532591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.123662263831788e-08 -2.093916637212404e-08 1.185816963610162e-08 ] [ 7.864843102837459e-10 -5.469325016034351e-09 2.779699372392539e-09 ] [ 5.874872448385786e-10 -6.288671410769664e-09 4.029403064670036e-09 ] [ 5.614661661660361e-09 -1.06132489216902e-09 -7.129661289040039e-09 ] [ -3.966920259288444e-09 2.543734484687343e-09 2.119858952882268e-09 ] [ -8.990998950443516e-09 1.821682460232081e-08 -1.575637077772967e-08 ] [ -6.49610906308853e-09 1.265991483891614e-08 5.388584767188095e-09 ] [ -8.771227742497733e-09 3.380139253904314e-10 -3.289683726464849e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.432472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.792989908115062e-18 } }