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View the latest research published by CMSP scientists.

Preprint
2026
Universality of Magic in Local Quantum Field Theory
Valentin Benedetti | Atish Dabholkar | Marcello Dalmonte
Preprint
2026
Glassy Signatures in Water's Second Liquid
Florian Pabst | Ali Hassanali
Preprint
2026
Chiral Graviton Modes in Non-Abelian lattice Fractional Quantum Hall states
Zeno Bacciconi | Min Long | Hernan Xavier | Hongyu Lu | Marcello Dalmonte | Zi Yang Meng
Preprint
2026
Hydrogen-Bond Donor-Acceptor Imbalance in Low-Frequency Terahertz Water Spectra
Lilian Najm Alsayed | Florian Pabst | Giuseppe Cassone | Ali Hassanali | Fabio Novelli
Preprint
2026
Chiral Graviton Modes in Fermionic Fractional Chern Insulators
Min Long | Zeno Bacciconi | Hongyu Lu | Hernan B. Xavier | Zi Yang Meng | Marcello Dalmonte
Preprint
2026
Quantum nuclear and band-dispersion effects recover near-UV absorption in short-hydrogen-bonded organic crystals
Jonas Hänseroth | Max Großmann | Malte Grunert | Ali Hassanali | Erich Runge | Christian Dreßler | Muhammad Nawaz Qaisrani
Journal article
2026
Generalized stochastic spin-wave theory for open quantum spin systems
Physical Review B (2026)
Zejian Li | Anna Delmonte | Rosario Fazio
Preprint
2026
Investigating causality between principal components in protein dynamics
Debarshi Banerjee | Ali Hassanali | Alessandro Laio
Journal article
2026
Good Practices for Simulation Studies Published in The Journal of Physical Chemistry B
The Journal of Physical Chemistry B (2026)
Christophe Chipot | Jiali Gao | Benoît Roux | Ali A. Hassanali | Barbara Kirchner | Joan-Emma Shea
Journal article
2026
Entanglement Transition in Unitary System-Bath Dynamics
Physical Review Letters (2026)
Bo Xing | Giuliano Chiriacò | Paola Cappellaro | Rosario Fazio | Dario Poletti
Preprint
2026
Transferable machine learning of excited-state dynamics with extremal pooling
Cesare Malosso | Wei Bin How | Gonzalo Díaz Mirón | Ali Hassanali | Michele Ceriotti
Journal article
2026
Computational Sciences from Africa and the African Diaspora
The Journal of Physical Chemistry C (2026)
Ali A Hassanali

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All publications
Journal article
2020
Understanding Förster Energy Transfer through the Lens of Molecular Dynamics.
Journal of chemical theory and computation (2020)
Anzola M | Sissa C | Painelli A | Hassanali AA | Grisanti L
Journal article
2020
Charge transfer as a ubiquitous mechanism in determining the negative charge at hydrophobic interfaces.
Nature communications (2020)
Poli E | Jong KH | Hassanali A
Journal article
2020
First-passage fingerprints of water diffusion near glutamine surfaces.
Soft matter (2020)
Belousov R | Qaisrani MN | Hassanali A | Roldán É
Journal article
2020
Toward Understanding Optical Properties of Amyloids: A Reaction Path and Nonadiabatic Dynamics Study.
Journal of the American Chemical Society (2020)
Grisanti L | Sapunar M | Hassanali A | Došlić N
Journal article
2020
Fast molecular compression by a hyperthermal collision gives bond-selective mechanochemistry
Physycal Review Letters (2020)
Martina Stella
Journal article
2020
Flexibilities of wavelets as a computational basis set for large-scale electronic structure calculations
The Journal of Chemical Physics (2020)
Laura E. Ratcliff | William Dawson | Giuseppe Fisicaro | Damien Caliste | Stephan Mohr | Augustin Degomme | Brice Videau | Viviana Cristiglio | Martina Stella | Marco D’Alessandro | Stefan Goedecker | Takahito Nakajima ...
Journal article
2020
Predicting Core Level Photoelectron Spectra of Amino Acids Using Density Functional Theory
Journal of Physical Chemistry Letters (2020)
Pi, J.M. | Stella, M. | Fernando, N.K. | Lam, A.Y. | Regoutz, A. | Ratcliff, L.E.
Journal article
2020
DFT insights into electrocatalytic CO<inf>2</inf> reduction to methanol on α-Fe<inf>2</inf>O<inf>3</inf>(0001) surfaces
Physical Chemistry Chemical Physics (2020)
Kumar, N. | Seriani, N. | Gebauer, R.
Journal article
2020
Heterostructures of ϵ-Fe<inf>2</inf>O<inf>3</inf>and α-Fe<inf>2</inf>O<inf>3</inf>: Insights from density functional theory
RSC Advances (2020)
Ahamed, I. | Seriani, N. | Gebauer, R. | Kashyap, A.
Journal article
2020
Why are MoS<inf>2</inf> monolayers not a good catalyst for the oxygen evolution reaction?
Applied Surface Science (2020)
German, E. | Gebauer, R.
Journal article
2020
The oxygen evolution reaction in hematite - Carbon nanotube composites: Insights from density functional theory
Computational Condensed Matter (2020)
Lodvert Tchibota Poaty | Bernard M’Passi-Mabiala | Ralph Gebauer
Journal article
2020
Renormalization to localization without a small parameter
SciPost Physics (2020)
Anton Kutlin | Ivan Khaymovich
Journal article
2020
Geometry-dependent effects in Majorana nanowires
Physical Review B (2020)
A. G. Kutlin | A. S. Mel'nikov
Journal article
2020
Generalized symmetry relations for connection matrices in the phase-integral method
Advances in Theoretical and Mathematical Physics (2020)
A. G. Kutlin
Preprint
2020
Renormalization to localization without a small parameter
A. G. Kutlin | I. M. Khaymovich
Preprint
2020
Geometry -- dependent effects in Majorana nanowires
A. G. Kutlin | A. S. Mel'nikov
Preprint
2020
Unsupervised learning universal critical behavior via the intrinsic dimension
T. Mendes-Santos | X. Turkeshi | M. Dalmonte | Alex Rodriguez
Journal article
2020
Negative absolute conductivity in photoexcited metals
Physical Review B (2020)
Giuliano Chiriacò | Andrew J. Millis | Igor L. Aleiner
Journal article
2020
Real-time dynamics of string breaking in quantum spin chains
Physical Review B (2020)
Roberto Verdel | Fangli Liu | Seth Whitsitt | Alexey V. Gorshkov | Markus Heyl
Preprint
2020
Mixed-state entanglement from local randomized measurements
Andreas Elben | Richard Kueng | Hsin-Yuan Huang | Rick van Bijnen | Christian Kokail | Marcello Dalmonte | Pasquale Calabrese | Barbara Kraus | John Preskill | Peter Zoller | Benoît Vermersch
Journal article
2020
Anderson transition on the Bethe lattice: An approach with real energies
Journal of Physics A: Mathematical and Theoretical (2020)
Parisi, G. | Pascazio, S. | Pietracaprina, F. | Ros, V. | Scardicchio, A.
Preprint
2020
Lattice Bisognano-Wichmann modular Hamiltonian in critical quantum spin chains
Jiaju Zhang | Pasquale Calabrese | Marcello Dalmonte | M. A. Rajabpour
Preprint
2020
Topological entanglement properties of disconnected partitions in the Su-Schrieffer-Heeger model
Tommaso Micallo | Vittorio Vitale | Marcello Dalmonte | Pierre Fromholz
Journal article
2020
Non-Abelian Symmetries and Disorder: A Broad Nonergodic Regime and Anomalous Thermalization
Physical Review X (2020)
Protopopov, I.V. | Panda, R.K. | Parolini, T. | Scardicchio, A. | Demler, E. | Abanin, D.A.
Preprint
2020
Exact many-body scars and their stability in constrained quantum chains
Federica Maria Surace | Matteo Votto | Eduardo Gonzalez Lazo | Alessandro Silva | Marcello Dalmonte | Giuliano Giudici
Preprint
2020
Measurement-induced criticality in (2+1)-d hybrid quantum circuits
Xhek Turkeshi | Rosario Fazio | Marcello Dalmonte
Journal article
2020
Phenomenology of anomalous transport in disordered one-dimensional systems
Journal of Statistical Mechanics: Theory and Experiment (2020)
Schulz, M. | Taylor, S.R. | Scardicchio, A. | Žnidarič, M.
Preprint
2020
Weak-ergodicity-breaking via lattice supersymmetry
Federica Maria Surace | Giuliano Giudici | Marcello Dalmonte
Journal article
2020
Subdiffusion in the Anderson model on the random regular graph
Physical Review B (2020)
De Tomasi, G. | Bera, S. | Scardicchio, A. | Khaymovich, I.M.
Preprint
2020
Polarity dependent heating at the phase interface in metal-insulator transitions
Giuliano Chiriacò | Andrew Millis

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