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This is the first one of a series of two papers aimed at investigating the relation of resonance-type effective Hamiltonians to molecular potential energy surfaces for linear ABA triatomic molecules, and more precisely for CO 2 . Single- or multi-resonance effective vibrational Hamiltonians are much simpler to handle than the exact one, yet retaining all its essential features, at least in...
This is the second one of a series of two papers aimed at investigating the relation of resonance-type effective Hamiltonians to molecular potential energy surfaces (PES) for linear ABA triatomic molecules, and more precisely for CO 2 . Whereas the first paper dealt with the theoretical background, this paper contains explicit numerical results for CO 2 . A six-parameter PES is first...
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