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ORCID"Electronic structure and optical properties of isolated and TiO2-grafted ..."
Syrine Daoudi et al. (2019)
- Syrine Daoudi, Abderrahmane Semmeq
, Michael Badawi, Xavier Assfeld, Youssef Arfaoui, Mariachiara Pastore:
Electronic structure and optical properties of isolated and TiO2-grafted free base porphyrins for water oxidation: A challenging test case for DFT and TD-DFT. J. Comput. Chem. 40(29): 2530-2538 (2019)
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