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Peter M Felker

5PUBLICATIONS

4CO-AUTHORS

Theoretical quantum chemistry

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Publications (5)

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|Aug 24, 2020

H<sub>2</sub>O-CO and D<sub>2</sub>O-CO complexes: Intra- and intermolecular rovibrational states from full-dimensional and fully coupled quantum calculations.

Peter M Felker, Zlatko Bačić

|Apr 04, 2020

Benzene-H<sub>2</sub>O and benzene-HDO: Fully coupled nine-dimensional quantum calculations of flexible H<sub>2</sub>O/HDO intramolecular vibrational excitations and intermolecular states of the dimers, and their infrared and Raman spectra using compact bases.

Peter M Felker, Zlatko Bačić

|Jan 10, 2020

Flexible water molecule in C<sub>60</sub>: Intramolecular vibrational frequencies and translation-rotation eigenstates from fully coupled nine-dimensional quantum calculations with small basis sets.

Peter M Felker, Zlatko Bačić

|Oct 03, 2019

Intramolecular stretching vibrational states and frequency shifts of (H<sub>2</sub>)<sub>2</sub> confined inside the large cage of clathrate hydrate from an eight-dimensional quantum treatment using small basis sets.

Peter M Felker, David Lauvergnat, Yohann Scribano

|Jul 15, 2019

Weakly bound molecular dimers: Intramolecular vibrational fundamentals, overtones, and tunneling splittings from full-dimensional quantum calculations using compact contracted bases of intramolecular and low-energy rigid-monomer intermolecular eigenstates.

Peter M Felker, Zlatko Bačić

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Frequent Collaborators

5 joint publications

Zlatko Bačić

1 joint publications

David Lauvergnat

1 joint publications

Yohann Scribano

1 joint publications

David M Benoit

Frequent Collaborators

5 joint publications

Zlatko Bačić

1 joint publications

David Lauvergnat

1 joint publications

Yohann Scribano

1 joint publications

David M Benoit

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