Theses most similar to those of author Ramachandran, Arathi
Assessment of the accuracy of DFT (Density Functional Theory) for the photochromic behavior of dihydroazulene (DHA) (2012) read it
- Advisor: W.H. Green, Jr.
- Department of Chemical Engineering
Density functional theory study of the conductivity of the biphenalenyl radical dimer
Lu, Aiyan (2007)
- Advisor: Troy Van Voorhis
- Department of Chemistry
AB initio theoretical studies of transition-metal, molecular, and photonic band-gap materials
Rappe, Andrew Marshall (1992)
- Advisor: John D. Joannopoulos
- Department of Chemistry
Theoretical investigation of solar energy conversion and water oxidation catalysis
Wang, Lee-Ping (2011)
- Advisor: Troy Van Voorhis
- Department of Chemistry
- Advisor: Troy Van Voorhis
- Department of Chemistry
Excited states and electron transfer in solution : models based on density functional theory
Kowalczyk, Timothy Daniel (2012)
- Advisor: Troy Van Voorhis
- Department of Chemistry
A multiscale study of atomic interactions in the electrochemical double layer applied to electrocatalysis
Bonnet, Nicéphore (2011)
- Advisor: Nicola Marzari
- Department of Nuclear Science and Engineering
Theoretical investigations of the electronic processes in organic photovoltaics
Yost, Shane Robert (2013)
- Advisor: Troy Van Voorhis
- Department of Chemistry
- Advisor: Gang Chen
- Department of Mechanical Engineering
Electron transfer in solution : nonadiabatic dynamics and applications to catalysis
Mavros, Michael G. (Michael George) (2016)
- Advisor: Troy Van Voorhis
- Department of Chemistry