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View the latest research published by CMSP scientists.

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
Journal article
2026
Current precision in interacting hybrid normal-superconducting systems
Physical Review B (2026)
Nahual Sobrino | Fabio Taddei | Rosario Fazio | Michele Governale
Preprint
2026
Machine learning the non-radiative decay modes in photochemical processes
Debarshi Banerjee | Gonzalo Díaz Mirón | Alex Rodriguez | Ali Hassanali
Preprint
2026
Causality in Liquid Water as a Hallmark of Emergent Glassy Dynamics
Leon Huet | Vittorio Del Tatto | Debarshi Banerjee | Alessandro Laio | Ali A. Hassanali
Preprint
2026
Beyond the Virial Expansion: Microscopic Origins of Partial Molar Volumes in LiCl Solutions
Chun-Ting Lin | Diganta Dasgupta | Tinglu Yang | Cesare Malosso | Giulia Sormani | Colin Egan | Giovanni Bussi | Ali Hassanali | Paul S. Cremer
Preprint
2026
Glassy Arrest Behind the Apparent Second Liquid in Water
Florian Pabst | Ali Hassanali

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All publications
Preprint
2022
Elastic stripes formation at electronic transitions
Giuliano Chiriacò | Andrew J. Millis
Preprint
2022
Gauge-theoretic origin of Rydberg quantum spin liquids
P. S. Tarabunga | F. M. Surace | R. Andreoni | A. Angelone | M. Dalmonte
Preprint
2022
Entanglement Hamiltonians: from field theory, to lattice models and experiments
M. Dalmonte | V. Eisler | M. Falconi | B. Vermersch
Preprint
2022
Critical light-matter entanglement at cavity mediated phase transition
Giuliano Chiriacò | Marcello Dalmonte | Titas Chanda
Journal article
2022
Negativity Hamiltonian: An Operator Characterization of Mixed-State Entanglement
Physical Review Letters (2022)
Marcello Dalmonte
Journal article
2022
Phase diagram of Rydberg-dressed atoms on two-leg triangular ladders
Physical Review B (2022)
Pierre Fromholz | Mikheil Tsitsishvili | Matteo Votto | Marcello Dalmonte | Alexander Nersesyan | Titas Chanda
Journal article
2022
Symmetry-resolved dynamical purification in synthetic quantum matter
SciPost Physics (2022)
Marcello Dalmonte
Journal article
2022
Critical light-matter entanglement at cavity mediated phase transitions
Physical Review B (2022)
Giuliano Chiriacò | Marcello Dalmonte | Titas Chanda
Journal article
2022
Dissipative Floquet Dynamics: from Steady State to Measurement Induced Criticality in Trapped-ion Chains
Quantum (2022)
Marcello Dalmonte
Journal article
2022
Entanglement transitions from stochastic resetting of non-Hermitian quasiparticles
Physical Review B (2022)
Xhek Turkeshi | Marcello Dalmonte | Rosario Fazio | Marco Schirò
Journal article
2022
Finite-temperature quantum discordant criticality
Physical Review B (2022)
Poetri Sonya Tarabunga | Tiago Mendes-Santos | Fabrizio Illuminati | Marcello Dalmonte
Journal article
2022
Phase diagram of Rydberg-dressed atoms on two-leg square ladders: Coupling supersymmetric conformal field theories on the lattice
Physical Review B (2022)
Mikheil Tsitsishvili | Titas Chanda | Matteo Votto | Pierre Fromholz | Marcello Dalmonte | Alexander Nersesyan
Journal article
2022
Measurement-induced criticality in extended and long-range unitary circuits
SciPost Physics Core (2022)
Marcello Dalmonte
Journal article
2022
Gauge-Theoretic Origin of Rydberg Quantum Spin Liquids
Physical Review Letters (2022)
P. S. Tarabunga | F. M. Surace | R. Andreoni | A. Angelone | M. Dalmonte
Journal article
2022
Observation of Strong Synergy in the Interfacial Water Response of Binary Ionic and Nonionic Surfactant Mixtures
The Journal of Physical Chemistry Letters (2022)
Sanghamitra Sengupta | Rahul Gera | Colin Egan | Uriel N. Morzan | Jan Versluis | Ali Hassanali | Huib J. Bakker
Journal article
2022
The behavior of methane–water mixtures under elevated pressures from simulations using many-body potentials
The Journal of Chemical Physics (2022)
Victor Naden Robinson | Raja Ghosh | Colin K. Egan | Marc Riera | Christopher Knight | Francesco Paesani | Ali Hassanali
Journal article
2022
High-Dimensional Fluctuations in Liquid Water: Combining Chemical Intuition with Unsupervised Learning
Journal of Chemical Theory and Computation (2022)
Adu Offei-Danso | Ali Hassanali | Alex Rodriguez
Journal article
2022
Learning the Hydrophobic, Hydrophilic, and Aromatic Character of Amino Acids from Thermal Relaxation and Interfacial Thermal Conductance
The Journal of Physical Chemistry B (2022)
Heydar Hamzi | Ali Rajabpour | Édgar Roldán | Ali Hassanali
Journal article
2022
Model Folded Hydrophobic Polymers Reside in Highly Branched Voids
The Journal of Physical Chemistry Letters (2022)
Khatereh Azizi | Alessandro Laio | Ali Hassanali
Journal article
2022
Non-Aromatic Fluorescence in Biological Matter: The Exception or the Rule?
The Journal of Physical Chemistry B (2022)
Uriel N. Morzan | Gonzalo Díaz Mirón | Luca Grisanti | Mariano C. González Lebrero | Gabriele S. Kaminski Schierle | Ali Hassanali
Journal article
2022
Charge Gradients around Dendritic Voids Cause Nanoscale Inhomogeneities in Liquid Water
The Journal of Physical Chemistry Letters (2022)
Tereza Schönfeldová | Nathan Dupertuis | Yixing Chen | Narjes Ansari | Emiliano Poli | David M. Wilkins | Ali Hassanali | Sylvie Roke
Journal article
2022
Intracellular Aβ42 Aggregation Leads to Cellular Thermogenesis
Journal of the American Chemical Society (2022)
Chyi Wei Chung | Amberley D. Stephens | Tasuku Konno | Edward Ward | Edward Avezov | Clemens F. Kaminski | Ali A. Hassanali | Gabriele S. Kaminski Schierle
Journal article
2022
Deep-learning density functionals for gradient descent optimization
Physical Review E (2022)
E. Costa | G. Scriva | R. Fazio | S. Pilati
Journal article
2022
How to determine solubility in binary mixtures from neutron scattering data: The case of methane and water
The Journal of Chemical Physics (2022)
Ciprian G. Pruteanu | Victor Naden Robinson | Ali Hassanali | Sandro Scandolo | John S. Loveday | Graeme J. Ackland
Journal article
2022
Nonlinear dynamics of the dissipative anisotropic two-photon Dicke model
New Journal of Physics (2022)
Jiahui Li | Rosario Fazio | Stefano Chesi
Journal article
2022
Hybrid ferromagnetic transmon qubit: Circuit design, feasibility, and detection protocols for magnetic fluctuations
Physical Review B (2022)
Halima Giovanna Ahmad | Valentina Brosco | Alessandro Miano | Luigi Di Palma | Marco Arzeo | Domenico Montemurro | Procolo Lucignano | Giovanni Piero Pepe | Francesco Tafuri | Rosario Fazio | Davide Massarotti
Preprint
2021
Scandium decorated C$_{24}$ fullerene as high capacity reversible hydrogen storage material: Insights from density functional theory simulations
Vikram Mahamiya | Alok Shukla | Brahmananda Chakraborty
Preprint
2021
Exploring yttrium doped C$_{24}$ fullerene as a high-capacity reversible hydrogen storage material: DFT investigations
Vikram Mahamiya | Alok Shukla | Brahmananda Chakraborty
Journal article
2021
Ab-initio, Monte Carlo and experimental investigation on structural, electronic and magnetic properties of Zn1-xNixO nanoparticles prepared via sol-gel method
Journal of Alloys and Compounds (2021)
Ahmoum, H. | Li, G. | Piao, Y. | Liu, S. | Gebauer, R. | Boughrara, M. | Su'ait, M.S. | Kerouad, M. | Wang, Q.
Journal article
2021
Sol-gel prepared Cu2ZnSnS4 (CZTS) semiconductor thin films: Role of solvent removal processing temperature
Materials Science in Semiconductor Processing (2021)
Ahmoum, H. | Chelvanathan, P. | Su'ait, M.S. | Boughrara, M. | Li, G. | Gebauer, R. | Sopian, K. | Kerouad, M. | Amin, N. | Wang, Q.

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