PADULA DANIELE | Professor page

Daoud, R., Orlando, A., Rampino, A., Tretti, M., Desando, M., Padula, D., et al. (2025). Computational Design of (B)Chl Models: Structural and Chemical Modifications toward Enriched Properties. JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL, 129(1), 139-152 [10.1021/acs.jpcb.4c06914]. - view more
Padula, D., Barneschi, L., Landi, A. (2025). Multiscale Modeling of Charge Transport in Organic Semiconductors: Assessing the Validity of the Harmonic Approximation for Low-Frequency Vibrations. JOURNAL OF PHYSICAL CHEMISTRY. C, 129(1), 784-792 [10.1021/acs.jpcc.4c06790]. - view more
Sedghi, M., Vael, C., Hu, W., Bauer, M., Padula, D., Landi, A., et al. (2024). Formation of electron traps in semiconducting polymers via a slow triple-encounter between trap precursor particles. SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS, 25(1) [10.1080/14686996.2024.2312148]. - view more
Padula, D. (2024). Discriminating Clockwise and Counterclockwise Photoisomerization Paths in Achiral Photoswitches by Excited-State Electronic Circular Dichroism. JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL, 128(35), 8303-8312 [10.1021/acs.jpcb.4c02384]. - view more
Barneschi, L., Rotondi, L., Padula, D. (2024). Molecular geometry impact on deep learning predictions of inverted singlet–triplet gaps. JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY, 128(12), 2417-2426 [10.1021/acs.jpca.4c00172]. - view more

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