Showing results (1-10 of 174) with videos related to

Sort By:
Pageof 18
Physical Chemistry Chemical Physics : PCCP|February 14, 2017
Aluminium and magnesium insertion in sulfur-based spinels: a first-principles studyVadym V Kulish, Daniel Koch, Sergei Manzhos
Physical Chemistry Chemical Physics : PCCP|August 16, 2017
Ab initio study of Li, Mg and Al insertion into rutile VO2: fast diffusion and enhanced voltages for multivalent batteriesVadym V Kulish, Daniel Koch, Sergei Manzhos
The Journal of Physical Chemistry Letters|March 23, 2017
On the Charge State of Titanium in Titanium DioxideDaniel Koch, Sergei Manzhos
Physical Chemistry Chemical Physics : PCCP|January 24, 2014
Controlling Na diffusion by rational design of Si-based layered architecturesVadym V Kulish, Oleksandr I Malyi, Man-Fai Ng, et al.
The Journal of Physical Chemistry. A|May 31, 2022
The Role of Local DFT+U Minima in the First-Principles Modeling of the Metal-Insulator Transition in Vanadium DioxideDaniel Koch, Sergei Manzhos, Mohamed Chaker
Physical Chemistry Chemical Physics : PCCP|April 19, 2017
Surface reactivity and vacancy defects in single-layer borophene polymorphsVadym V Kulish
Physical Chemistry Chemical Physics : PCCP|September 14, 2019
Revisiting π backbonding: the influence of d orbitals on metal-CO bonds and ligand red shiftsDaniel Koch, Yingqian Chen, Pavlo Golub, et al.
Molecules (Basel, Switzerland)|September 28, 2021
Density-Based Descriptors of Redox Reactions Involving Transition Metal Compounds as a Reality-Anchored Framework: A PerspectiveDaniel Koch, Mohamed Chaker, Manabu Ihara, et al.
Physical Chemistry Chemical Physics : PCCP|February 21, 2020
Reply to the 'Comment on "Revisiting π backbonding: the influence of d orbitals on metal-CO bonds and ligand red shifts"' by G. Frenking and S. Pan, Phys. Chem. Chem. Phys., 2019, 22, DOI: 10.1039/C9CP05951BDaniel Koch, Yingqian Chen, Pavlo Golub, et al.
Physical Chemistry Chemical Physics : PCCP|October 18, 2021
Reply to the 'Comment on "Revisiting π backbonding: the influence of d orbitals on metal-CO bonds and ligand red shifts"' by G. Frenking and S. Pan, Phys. Chem. Chem. Phys., 2019, 22, DOI: 10.1039/C9CP05951BDaniel Koch, Yingqian Chen, Pavlo Golub, et al.
Pageof 18