Sean Holmes
Postdoctoral Associate
CIMAR, NMR

Contact Information
sholmes2@fsu.edu | |
Phone | (850) 644-3810 |
Address |
95 Chieftan Way Rm. Tallahassee , FL 32306-4390 |
Building | CSL |
Publications and Scientific Activities
- Chemical Shift Tensors of Cimetidine Form A Modeled with Density Functional Theory Calculations: Implications for NMR Crystallography Journal of Physical Chemistry A, 124, 3109-3119 (2020)
- Dispersion-Corrected DFT Methods for Applications in NMR Crystallography Journal of Physical Chemistry A, 124, 10312-10323 (2020)
- In Situ Characterization of Waters of Hydration in a Variable-Hydrate Active Pharmaceutical Ingredient using 35Cl Solid-State NMR and X-ray Diffraction Crystal Growth and Design, 12, 7349-7362 (2019)
- Frequency-Swept Pulses and Pulses Designed with Optimal Control Theory for Ultra-Wideline NMR Spectroscopy 48th Southeast Magnetic Resonance Conference (SEMRC) Gainesville, Florida, United States Oct. 26 (2019)
- Solid-state NMR investigations of active pharmaceutical ingredients and multi-component crystals formed by mechanochemical syntheses Eastern Analytical Symposium and Exposition Nov. 1820, 2019 Princeton, New Jersey, United States Nov. 1820 (2019)
- Mechanochemical Synthesis of HCl API Multi-Component Crystals and their Structural Refinement and Elucidation Using 35Cl SSNMR and Dispersion-Corrected DFT Calculations. 48th Southeast Magnetic Resonance Conference (SEMRC) Gainesville, Florida, United States October 25-27 (2019)
- DFT/ZORA calculations of Cd and Pt magnetic shielding tensors 48th Southeast Magnetic Resonance Conference (SEMRC) Gainesville, Florida, United States October 25-27 (2019)
- New Pulse Sequences for Ultra-Wideline NMR Spectroscopy 2019 Gateway NMR Meeting Ann Arbor, Michigan, United States Sep. 21-22 (2019)