Projects per year
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Dive into the research topics where Michele Pavanello is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Projects
- 3 Finished
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ELECTRON-RICH OXIDE SURFACES
National Science Foundation (National Science Foundation (NSF))
8/15/17 → 7/31/20
Project: Research project
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CAREER: CDS&E: NONLOCAL AND PERIODIC DENSITY EMBEDDING
National Science Foundation (National Science Foundation (NSF))
12/1/16 → 11/30/21
Project: Research project
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Many-body van der Waals interactions in wet MoS2surfaces
Shao, X., Umerbekova, A., Jiang, K. & Pavanello, M., Jun 1 2022, In: Electronic Structure. 4, 2, 024001.Research output: Contribution to journal › Article › peer-review
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Role of Dielectric Screening in Calculating Excited States of Solvated Azobenzene: A Benchmark Study Comparing Quantum Embedding and Polarizable Continuum Model for Representing the Solvent
Chakravarty, C., Aksu, H., Martinez B., J. A., Ramos, P., Pavanello, M. & Dunietz, B. D., 2022, (Accepted/In press) In: Journal of Physical Chemistry Letters. p. 4849-4855 7 p.Research output: Contribution to journal › Article › peer-review
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DFTpy: An efficient and object-oriented platform for orbital-free DFT simulations
Shao, X., Jiang, K., Mi, W., Genova, A. & Pavanello, M., Jan 1 2021, In: Wiley Interdisciplinary Reviews: Computational Molecular Science. 11, 1, e1482.Research output: Contribution to journal › Review article › peer-review
7 Scopus citations -
Efficient DFT solver for nanoscale simulations and beyond
Shao, X., Mi, W. & Pavanello, M., May 6 2021, In: Journal of Physical Chemistry Letters. 12, 17, p. 4134-4139 6 p.Research output: Contribution to journal › Article › peer-review
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eQE 2.0: Subsystem DFT beyond GGA functionals
Mi, W., Shao, X., Genova, A., Ceresoli, D. & Pavanello, M., Dec 2021, In: Computer Physics Communications. 269, 108122.Research output: Contribution to journal › Article › peer-review