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Physical Chemistry Chemical Physics : PCCP|April 22, 2021
Challenges for density functional theory: calculation of CO adsorption on electrocatalytically relevant metalsChristianna N Lininger, Joseph A Gauthier, Wan-Lu Li, et al.Journal of the American Chemical Society|May 23, 2022
Copper(III) Metallacyclopentadienes via Zirconocene Transfer and Reductive Elimination to an Isolable PhenanthrocyclobutadieneHarrison M Bergman, D Dawson Beattie, Rex C Handford, et al.Journal of Chemical Theory and Computation|August 30, 2022
Time-Dependent Second-Order Green's Function Theory for Neutral ExcitationsWenjie Dou, Joonho Lee, Jian Zhu, et al.Journal of the American Chemical Society|August 12, 2015
Critical Factors Driving the High Volumetric Uptake of Methane in Cu₃(btc)₂Zeric Hulvey, Bess Vlaisavljevich, Jarad A Mason, et al.Journal of the American Chemical Society|November 18, 2020
Metal-Ligand Cooperativity via Exchange Coupling Promotes Iron- Catalyzed Electrochemical CO2 Reduction at Low OverpotentialsJeffrey S Derrick, Matthias Loipersberger, Ruchira Chatterjee, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|September 14, 2020
Siloxyaluminate and Siloxygallate Complexes as Models for Framework and Partially Hydrolyzed Framework Sites in Zeolites and ZeotypesJames P Dombrowski, Micah S Ziegler, Neelay M Phadke, et al.Materials (Basel, Switzerland)|December 8, 2019
Thermophysical Measurements in Liquid Alloys and Phase Diagram StudiesYuri Kirshon, Shir Ben Shalom, Moran Emuna, et al.Physical Review Letters|May 3, 2014
Limit of metastability for liquid and vapor phases of waterWoo Jong Cho, Jaegil Kim, Joonho Lee, et al.Journal of the American Chemical Society|November 2, 2023
The Energetic Origins of Pi-Pi Contacts in ProteinsKevin Carter-Fenk, Meili Liu, Leila Pujal, et al.Nature|March 17, 2022
Unbiasing fermionic quantum Monte Carlo with a quantum computerWilliam J Huggins, Bryan A O'Gorman, Nicholas C Rubin, et al.Pageof 740