Connecting Vibrational Spectroscopy to Atomic Structure via Supervised Manifold Learning: Beyond Peak Analysis
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DOI: 10.1021/acs.chemmater.2c03207
Abstract: Vibrational spectroscopy is a nondestructive technique commonly used in chemical and physical analyses to determine atomic structures and associated properties. However, the evaluation and interpretation of spectroscopic profiles based on human-identifiable peaks can be difficult… read more here.
Keywords: spectroscopy; manifold learning; peak analysis; supervised manifold ... See more keywords