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• W2801235512 abstract "The influence of non-adiabatic effects on the ro-vibrational bound states of H+ 3 has been investigated using geometry-dependent reduced masses and only one single potential energy surface. The used potentials (BO electronic energy, adiabatic corrections and relativistic contributions) are based on explicitly correlated wavefunctions. For the first time, several different fully geometry-dependent reduced mass surfaces in three dimensions have been incorporated for the vibrational and rotational contributions." @default.
• W2801235512 created "2018-05-17" @default.
• W2801235512 creator A5049933521 @default.
• W2801235512 creator A5089225898 @default.
• W2801235512 date "2018-04-30" @default.
• W2801235512 modified "2023-09-24" @default.
• W2801235512 title "Investigation of non-adiabatic effects for the ro-vibrational spectrum of H₃⁺: the use of a single potential energy surface with geometry-dependent nuclear masses" @default.
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• W2801235512 doi "https://doi.org/10.1080/00268976.2018.1464225" @default.
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