Accelerating Anharmonic Spectroscopy Simulations via Local-Mode, Multilevel Methods von Zhanserkeev, Asylbek A., Yang, Emily L., Steele, Ryan P.

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The Near-Sightedness of Many-Body Interactions in Anharmonic Vibrational Couplings von Spencer, Ryan J., Zhanserkeev, Asylbek A., Yang, Emily L., Steele, Ryan P.

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Adiabatic Molecular Orbital Tracking in Ab Initio Molecular Dynamics von Zhanserkeev, Asylbek A, Talbot, Justin J, Steele, Ryan P

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Accelerating and stabilizing the convergence of vibrational self-consistent field calculations via the direct inversion of the iterative subspace (vDIIS) algorithm von Yang, Emily L., Spencer, Ryan J., Zhanserkeev, Asylbek A., Talbot, Justin J., Steele, Ryan P.

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Role of Ligand-Bound CO2 in the Hydrogenation of CO2 to Formate with a (PNP)Mn Catalyst von Schlenker, Kevin, Christensen, Elizabeth G, Zhanserkeev, Asylbek A, McDonald, Gabriel R, Yang, Emily L, Lutz, Kevin T, Steele, Ryan P, VanderLinden, Ryan T, Saouma, Caroline T

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Role of Ligand-Bound CO 2 in the Hydrogenation of CO 2 to Formate with a (PNP)Mn Catalyst von Schlenker, Kevin, Christensen, Elizabeth G., Zhanserkeev, Asylbek A., McDonald, Gabriel R., Yang, Emily L., Lutz, Kevin T., Steele, Ryan P., VanderLinden, Ryan T., Saouma, Caroline T.

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