Showing results (391-400 of 7,390) with videos related to
Sort By:
Pageof 739
The Journal of Physical Chemistry Letters|May 7, 2020
Solvent Mediated Excited State Proton Transfer in Indigo CarminePartha Pratim Roy, James Shee, Eric A Arsenault, et al.Journal of the American Chemical Society|April 29, 2021
Controlled Single-Electron Transfer via Metal-Ligand Cooperativity Drives Divergent Nickel-Electrocatalyzed Radical PathwaysAnna Wuttig, Jeffrey S Derrick, Matthias Loipersberger, et al.Journal of Chemical Theory and Computation|January 21, 2025
Second-Generation Energy Decomposition Analysis of Intermolecular Interaction Energies from the Second-Order Mo̷ller-Plesset Theory: An Extensible, Orthogonal Formulation with Useful Basis Set Convergence for All TermsZhenling Wang, Kevin Ikeda, Hengyuan Shen, et al.The Journal of Chemical Physics|July 19, 2023
Probing C-I bond fission in the UV photochemistry of 2-iodothiophene with core-to-valence transient absorption spectroscopyBenjamin W Toulson, Diptarka Hait, Davide Faccialà, et al.Chemical Science|June 24, 2021
Consistent inclusion of continuum solvation in energy decomposition analysis: theory and application to molecular CO2 reduction catalystsYuezhi Mao, Matthias Loipersberger, Kareesa J Kron, et al.Journal of Chemical Theory and Computation|February 8, 2024
Highly Accurate Prediction of NMR Chemical Shifts from Low-Level Quantum Mechanics Calculations Using Machine LearningJie Li, Jiashu Liang, Zhe Wang, et al.The Journal of Physical Chemistry Letters|August 12, 2015
What Is the Structure of the Naphthalene-Benzene Heterodimer Radical Cation? Binding Energy, Charge Delocalization, and Unexpected Charge-Transfer Interaction in Stacked Dimer and Trimer Radical CationsIsaac K Attah, Sean P Platt, Michael Meot-Ner Mautner, et al.The Journal of Physical Chemistry. A|February 8, 2023
Force Decomposition Analysis: A Method to Decompose Intermolecular Forces into Physically Relevant Component ContributionsAbdulrahman Aldossary, Martí Gimferrer, Yuezhi Mao, et al.Chemical Science|April 17, 2023
Caught in the act: real-time observation of the solvent response that promotes excited-state proton transfer in pyranineClaudius Hoberg, Justin J Talbot, James Shee, et al.Science (New York, N.Y.)|May 4, 2023
Femtosecond symmetry breaking and coherent relaxation of methane cations via x-ray spectroscopyEnrico Ridente, Diptarka Hait, Eric A Haugen, et al.Pageof 739