Figure 5
Calculated Compton profiles using CRYSTAL09 for air (O2 + 3.76N2) (black solid line), CO2 (red solid line), H2O (blue solid line), C3H8 (black dashed line) and Hartree–Fock calculation (Biggs et al., 1975) for atomic H (blue dots). The Compton profiles are normalized using equations (9) and (10) (see text). |