Dalal K. Kanan

First principles scheme to evaluate band edge positions in potential transition metal oxide photocatalysts and photoelectrodes

Maytal Caspary Toroker, Dalal K. Kanan, Nima Alidoust et al. · Physical Chemistry Chemical Physics · 2011 · 454 citations

Engineering, Inorganic Photochemistry, Electronic Band Edges +20

Band Gap Engineering of MnO via ZnO Alloying: A Potential New Visible-Light Photocatalyst

Dalal K. Kanan, Emily A. Carter · The Journal of Physical Chemistry C · 2012 · 134 citations

Quantum mechanical modeling of electronic excitations in metal oxides: Magnesia as a prototype

Dalal K. Kanan, Sahar Sharifzadeh, Emily A. Carter · Chemical Physics Letters · 2011 · 32 citations

Materials Science, Spintronics, Metal Oxides +14

One and Two Hydrogen Molecules in the Large Cage of the Structure II Clathrate Hydrate:  Quantum Translation−Rotation Dynamics Close to the Cage Wall

F. Sebastianelli, Minzhong Xu, Dalal K. Kanan et al. · The Journal of Physical Chemistry A · 2007 · 28 citations

Hydrogen Molecules, Engineering, Computational Chemistry +16

Ab initio study of electron and hole transport in pure and doped MnO and MnO:ZnO alloy

Dalal K. Kanan, Emily A. Carter · Journal of Materials Chemistry A · 2013 · 24 citations

Engineering, Hole Transport, Photo-electrochemical Cell +16