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Paesani Lab

@PaesaniLab

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Working at the intersection of quantum chemistry, statistical mechanics, and computer/data science at @UCSanDiego. Account managed by all group members.

La Jolla, CA
Joined October 2017
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@PaesaniLab
Paesani Lab
2 months
🚨 Just published in @J_A_C_S! 🚨. What happens to the pH of #water when it’s squeezed into a space thinner than a nanometer?πŸ€”. πŸ‘‰ In our latest study, we show that sub-nanometer confinement suppresses #water autoionization, raising its pKw by more than
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@PaesaniLab
Paesani Lab
22 hours
πŸŽ‰ Big news from our group!. Our former #PhD student Teri Lambros is kicking off his independent career as an Assistant Professor of Physics at CSU-Fullerton (@csuf)! πŸ‘. In our group, Teri pushed QM/MM approaches with #datadriven #manybody potentials and extended our #manybody
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@grok
Grok
7 days
Join millions who have switched to Grok.
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@PaesaniLab
Paesani Lab
4 days
πŸ₯€ Today we had a special farewell boba tea with Dr. Ruihan Zhou! πŸ„β€β™‚οΈ. Ruihan took our #datadriven #manybody potentials from small molecules all the way to peptides 🧬 , opening the door to protein simulations with coupled-cluster accuracy πŸ”₯. A leap toward predictive,
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@PaesaniLab
Paesani Lab
5 days
RT @UCSDChemBiochem: πŸŽ‰ Congrats to Prof. Vicki Grassian on her #Festschrift in @JPhysChem A! This special issue celebrates her trailblazing….
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@PaesaniLab
Paesani Lab
7 days
Every summer we celebrate a special tradition in our group: the passing of #Quelo ✨. This year, Etienne, Hilliary, Ruihan, and Yuanhui graduated πŸŽ“ and handed #Quelo to the new 5th-year #pirates: Richa, Henry, Cianna, Ethan, and Xuanyu! πŸš€. Here’s to a new year of discoveries
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@PaesaniLab
Paesani Lab
9 days
Big congratulations to Prof. Josh Figueroa for winning the 2026 @AmerChemSociety F. Albert Cotton Award! πŸ‘ An amazing honor that highlights his fantastic work in organometallic chemistry. @UCSanDiego @UCSDPhySci @UCSDChemBiochem.
@UCSDChemBiochem
UCSD Chem Biochem
13 days
Congratulations to Prof. Joshua Figueroa, recipient of the 2026 F. Albert Cotton Award in Synthetic Inorganic Chemistry from @AmerChemSociety! This prestigious ACS National Award recognizes his groundbreaking contributions to organometallic chemistry. @UCSanDiego @UCSDPhySci
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@PaesaniLab
Paesani Lab
9 days
Big congratulations to Prof. Akif Tezcan on the 2026 @AmerChemSociety Alfred Bader Award! πŸŽ‰ Well-deserved recognition for his creative work bridging chemistry and biology. @UCSanDiego @UCSDPhySci @UCSDChemBiochem.
@UCSDChemBiochem
UCSD Chem Biochem
13 days
Congratulations to Prof. Akif Tezcan, recipient of the 2026 Alfred Bader Award in Bioinorganic or Bioorganic Chemistry from @AmerChemSociety! This prestigious ACS National Award recognizes his pioneering research at the interface of chemistry and biology. @UCSanDiego @UCSDPhySci
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@PaesaniLab
Paesani Lab
9 days
Interesting read. 😎.
@COF_papers
COF_Papers
11 days
Intermolecular Interactions Override Chemical Intuition in Tuning Stacking and Electronic Properties of Functionalized Two-Dimensional Covalent Organic Frameworks
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@PaesaniLab
Paesani Lab
12 days
🚨 Just published in @ChemMater! 🚨. What really controls stacking and electronic properties in 2D #COFs? Spoiler: it’s not simple donor vs acceptor chemistry. 🀯. πŸ‘‰ In our study, we show that:.βœ… van der Waals interactions set the preference for slipped
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@PaesaniLab
Paesani Lab
14 days
Congrats! πŸŽ‰.
@UCSDChemBiochem
UCSD Chem Biochem
15 days
Huge congratulations to Prof. Julia Stauber on receiving a prestigious @NIH MIRA award for her project β€œPrecision, Functional Glyconanoassemblies through Supramolecular Design”! Stay tuned for more exciting science!. @UCSanDiego @UCSDPhySci
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@PaesaniLab
Paesani Lab
18 days
πŸŽ‰ Huge congratulations to Dr. Ruihan Zhou on a stellar #PhD defense!. Ruihan took our #datadriven #manybody potentials from small molecules all the way to peptides 🧬, opening the door to protein simulations with coupled-cluster accuracy πŸ”₯. This is a leap toward predictive,
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@PaesaniLab
Paesani Lab
21 days
🚨 New preprint on @ChemRxiv! 🚨. Can we model #biomolecules 🧬 in #water 🌊 with chemical accuracy? We’re getting there! πŸ„β€β™€οΈ. πŸ‘‰ In this work, we extend our #datadriven #manybody MB-nrg formalism to model #biomolecules in MB-pol #water, bringing CCSD(T)
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@PaesaniLab
Paesani Lab
22 days
Out in @PNASNews: Szukalo, Giovambattista & Debenedetti use DP_MBpol, our #machinelearning DNN@MB-pol model trained on MB-pol (, to explore glassy #water and its transformations between low-density (LDA) and high-density (HDA) forms. 😎. πŸ‘‰
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@PaesaniLab
Paesani Lab
1 month
βš“οΈ The #PaesaniGroup pirates have landed at the GRC Chemistry & Physics of Liquids (!. Richa, Xuanyu, Henry, and Suman are ready for a week packed with liquid-state science and good discussions. If you’re here too, come say hi during the poster sessions!
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