Decoding Chemical Information from Vibrational Spectroscopy Data - Q-Chem Webinar 66

Explore the power of local vibrational mode theory in decoding chemical information from vibrational spectroscopy data in this 59-minute webinar presented by Elfi Kraka and Marek Freindorf. Gain insights into the underlying theory and practical applications of this useful tool for characterizing chemical bonding and weak chemical interactions. Learn how the open-source program LModeA integrates with quantum chemistry packages like Q-Chem and measured spectra to provide valuable insights into chemical systems. Discover practical examples and demonstrations that illustrate the application of these methods in real-world scenarios. Benefit from the expertise of Dr. Elfi Kraka, Professor and Chair of the Department of Chemistry at Southern Methodist University, and Dr. Marek Freindorf, Research Professor in the same department, as they share their knowledge in artificial intelligence, vibrational spectroscopy, catalysis, materials, drug design, and theoretical molecular spectroscopy.

Q-Chem Webinar 66: Decoding chemical information from vibrational spectroscopy data