Spectroscopic investigation of [Al, N, C, O] refractory molecules T Trabelsi, MC Davis, RC Fortenberry, JS Francisco The Journal of Chemical Physics 151 (24), 2019 | 25 | 2019 |
Pathways to Detection of Strongly-Bound Inorganic Species: The Vibrational and Rotational Spectral Data of AlH2OH, HMgOH, AlH2NH2, and HMgNH2 AG Watrous, MC Davis, RC Fortenberry Frontiers in Astronomy and Space Sciences 8, 643348, 2021 | 18 | 2021 |
Ring-opening attachment as an explanation for the long lifetime of the octafluorooxolane anion T Sommerfeld, MC Davis The Journal of Chemical Physics 149 (8), 2018 | 13 | 2018 |
Vibrational and rotational spectral data for possible interstellar detection of AlH3OH2, SiH3OH, and SiH3NH2 AG Watrous, BR Westbrook, MC Davis, RC Fortenberry Monthly Notices of the Royal Astronomical Society 508 (2), 2613-2619, 2021 | 10 | 2021 |
(T)+ EOM Quartic Force Fields for Theoretical Vibrational Spectroscopy of Electronically Excited States MC Davis, RC Fortenberry Journal of Chemical Theory and Computation 17 (7), 4374-4382, 2021 | 7 | 2021 |
Excluded-volume descriptors for dipole-bound anions: Amine N-oxides as a test case T Sommerfeld, MC Davis The Journal of Chemical Physics 152 (5), 2020 | 7 | 2020 |
Confirmation of gaseous methanediol from state-of-the-art theoretical rovibrational characterization MC Davis, NR Garrett, RC Fortenberry Physical Chemistry Chemical Physics 24 (31), 18552-18558, 2022 | 5 | 2022 |
F12+ EOM Quartic Force Fields for Rovibrational Predictions of Electronically Excited States MC Davis, NR Garrett, RC Fortenberry The Journal of Physical Chemistry A 127 (22), 4771-4779, 2023 | 4 | 2023 |
Complete, Theoretical Rovibronic Spectral Characterization of the Carbon Monoxide, Water, and Formaldehyde Cations MC Davis, X Huang, RC Fortenberry Molecules 28 (4), 1782, 2023 | 4 | 2023 |
Performance of EOM-CCSD (T)(a)*-Based Quartic Force Fields in Computing Fundamental, Anharmonic Vibrational Frequencies of Molecular Electronically Excited States with … AG Watrous, MC Davis, RC Fortenberry The Journal of Physical Chemistry A 128 (11), 2150-2161, 2024 | | 2024 |
DFT+ F12 QFFs for Cost-Effective Rovibrational Spectral Data Predictions of Ground and Excited Electronic States NR Garrett, MC Davis, RC Fortenberry Journal of Chemical Theory and Computation 20 (3), 1324-1336, 2024 | | 2024 |
Theoretical Spectroscopy of Electronically Excited States MC Davis The University of Mississippi, 2023 | | 2023 |
F12+ DFT Quartic Force Fields for Cost-Effective Theoretical Spectroscopy N Garrett, M Davis, R Fortenberry Bulletin of the American Physical Society 67, 2022 | | 2022 |