Bulletin of the American Physical Society
92nd Annual Meeting of the Southeastern Section of the APS
Thursday–Saturday, October 23–25, 2025; Festival Conference and Student Center, James Madison University, Harrisonburg, Virginia
Session F02: Machine Learning Techniques and Applications
8:45 AM–9:57 AM,
Friday, October 24, 2025
James Madison University
Room: EnGeo 1209
Chair: Prakash Gautam, University of Virginia
Abstract: F02.00002 : Theoretical and Machine Learning Methods in Extracting Spin-Lattice Relaxation for Ammonia*
8:57 AM–9:09 AM
Presenter:
Shane Clements
(University of Virginia)
Authors:
Shane Clements
(University of Virginia)
Dustin Keller
(University of Virginia)
a considerable amount of time for experimental data taking is lost. To
optimize this, it is perhaps possible to determine the thermal equilibrium
polarization while the enhanced signal is not fully relaxed. To do this
using artificial intelligence, high-quality training data for the spin-lattice
relaxation (T1) is required at different temperatures and different accu-
mulated doses for a specific polarized target material such as NH3. In this
presentation, we find a theoretical T1 value for solid NH3 at 1 Kelvin in
a 5 Tesla magnetic field using basic principles of the NH3 cell geometry
and nuclear spin interactions. We construct a model of the NH3 super cell
and used known expressions for the transition rates between spin states
and the dipolar interaction tensor to find the relaxation matrix of the sys-
tem. We then discuss the calculation of the correlation time, and compute
the eigenvalues of the relaxation matrix to find the T1 time. This model
will be parameterized with real experimental data and used to generate
training data for further studies of thermal equilibrium analysis.
*This work was supported by DOE contract DE-FG02-96ER40950.
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