NCrystal WARNING: Discarding 52 edges of provided kernel data due to missing S values. ---------------------------------------------------------------------------------------------------- ------------------------------------ NCrystal Material Info ------------------------------------ ---------------------------------------------------------------------------------------------------- Data source: stdlib::LiquidWaterH2O_T293.6K.ncmat ---------------------------------------------------------------------------------------------------- Density : 0.9982 g/cm3, 0.100104 atoms/Aa^3 ---------------------------------------------------------------------------------------------------- Composition (by mole): 66.6667% H 33.3333% O ---------------------------------------------------------------------------------------------------- Composition (by mass): 11.1902% H 88.8098% O ---------------------------------------------------------------------------------------------------- Atom data: H = H(cohSL=-3.739fm cohXS=1.75679barn incXS=80.26barn absXS=0.3326barn mass=1.00798u Z=1) O = O(cohSL=5.803fm cohXS=4.2317barn incXS=0.0008barn absXS=0.00019barn mass=15.9993u Z=8) ---------------------------------------------------------------------------------------------------- Averaged quantities: Atomic mass : 6.00509u Absorption XS at 2200m/s : 0.221797 barn Free scattering XS : 14.9086 barn Scattering length density : -0.558911 10^-6/Aa^2 ---------------------------------------------------------------------------------------------------- Temperature : 293.6 kelvin ---------------------------------------------------------------------------------------------------- State of matter: Liquid ---------------------------------------------------------------------------------------------------- Dynamic info for H (66.6667%): type: S(alpha,beta) egrid: auto -> 4.02 eV alpha-grid : 1.00145e-05 -> 517.559 (189 points) beta-grid : -158.097 -> 158.097 (595 points) S(alpha,beta): 112455 points, S_max = 505278 Dynamic info for O (33.3333%): type: freegas ----------------------------------------------------------------------------------------------------