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Journal of Biological Inorganic Chemistry : JBIC : a Publication of the Society of Biological Inorganic Chemistry|September 1, 2005
Kinetics and DFT studies on the reaction of copper(II) complexes and H2O2Takao Osako, Shigenori Nagatomo, Teizo Kitagawa, et al.The Journal of Physical Chemistry Letters|August 20, 2015
Resolution of a Challenge for Solvation Modeling: Calculation of Dicarboxylic Acid Dissociation Constants Using Mixed Discrete-Continuum Solvation ModelsAleksandr V Marenich, Wendu Ding, Christopher J Cramer, et al.Inorganic Chemistry|March 17, 2004
Mechanistic studies on the formation and reactivity of dioxygen adducts of diiron complexes supported by sterically hindered carboxylatesSergey V Kryatov, Ferman A Chavez, Anne M Reynolds, et al.ACS Macro Letters|May 16, 2022
Structural Basis for the Different Mechanical Behaviors of Two Chemically Analogous, Carbohydrate-Derived ThermosetsC Maggie Lau, Sung-Soo Kim, Leon M Lillie, et al.Inorganic Chemistry|March 23, 2019
Revisiting the Synthesis and Nucleophilic Reactivity of an Anionic Copper Superoxide ComplexWilson D Bailey, Nicole L Gagnon, Courtney E Elwell, et al.Biomacromolecules|September 25, 2009
Consequences of polylactide stereochemistry on the properties of polylactide-polymenthide-polylactide thermoplastic elastomersCarolyn L Wanamaker, Michael J Bluemle, Louis M Pitet, et al.The Journal of Physical Chemistry. B|August 31, 2011
Use of solution-phase vibrational frequencies in continuum models for the free energy of solvationRaphael F Ribeiro, Aleksandr V Marenich, Christopher J Cramer, et al.Journal of Chemical Theory and Computation|December 5, 2015
Charge Model 4 and Intramolecular Charge PolarizationRyan M Olson, Aleksandr V Marenich, Christopher J Cramer, et al.Physical Chemistry Chemical Physics : PCCP|September 14, 2007
Benchmark RI-MP2 database of nucleic acid base trimers: performance of different density functional models for prediction of structures and binding energiesMartin Kabelác, Haydee Valdes, Edward C Sherer, et al.The Journal of Physical Chemistry. B|November 28, 2006
PdnCO (n = 1,2): accurate Ab initio bond energies, geometries, and dipole moments and the applicability of density functional theory for fuel cell modelingNathan E Schultz, Benjamin F Gherman, Christopher J Cramer, et al.Pageof 34