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View the latest research published by CMSP scientists.

Preprint
2025
Real-time scattering and freeze-out dynamics in Rydberg-atom lattice gauge theory
De-Sheng Xiang | Peng Zhou | Chang Liu | Hao-Xiang Liu | Yao-Wen Zhang | Dong Yuan | Kuan Zhang | Biao Xu | Marcello Dalmonte | Dong-Ling Deng | Lin Li
Journal article
2025
Many-body open quantum systems
SciPost Physics Lecture Notes (2025)
Rosario Fazio | Jonathan Keeling | Leonardo Mazza | Marco Schirò
Journal article
2025
Short-range order stabilizes a cubic iron alloy in Earth’s inner core
Nature Communications (2025)
Zhi Li | Sandro Scandolo
Journal article
2025
Acid–Base Chemistry of Short Hydrogen Bonds: A Tale of Schrödinger’s Cat in Glutamine-Derived Crystals
The Journal of Physical Chemistry Letters (2025)
Muhammad Nawaz Qaisrani | Nandha Kumar | Christian Dreßler | Ralph Gebauer | Ali Hassanali
Journal article
2025
Quantum Computing for Photosensitizer Design in Photodynamic Therapy
Annual Review of Biomedical Data Science (2025)
Hope Zehr | Alberto Baiardi | Francesco Tacchino | Anthony Gandon | Laurin E. Fischer | Yue Xu | Frank P. DiFilippo | Leonardo Guidoni | Pi A.B. Haase | Walter N. Talarico | Martina Stella | Fabio Tarocco | Anton Nykänen ...
Preprint
2025
Acid Base Chemistry of Short Hydrogen Bonds: A Tale of Schr\'odinger's Cat in Glutamine-Derived Crystals
Muhammad Nawaz Qaisrani | Nandha Kumar | Christian Dreßler | Ralph Gebauer | Ali Hassanali
Preprint
2025
Opportunities and Challenges in Unsupervised Learning: The Case of Aqueous Electrolyte Solutions
Giulia Sormani | Alex Rodriguez | Ali Hassanali
Preprint
2025
pH-Driven Fluorescence in Solid-State Lysine
Marta Monti | Luca Cimmino | Gonzalo Díaz Mirón | Carlo Diaferia | Debarshi Banerjee | Martina Stella | Luigi Vitagliano | Antonella Accardo | Ali Hassanali
Preprint
2025
Robustness of Magic in the quantum Ising chain via Quantum Monte Carlo tomography
Hari Timsina | Yi-Ming Ding | Emanuele Tirrito | Poetri Sonya Tarabunga | Bin-Bin Mao | Mario Collura | Zheng Yan | Marcello Dalmonte
Preprint
2025
Universal Spreading of Nonstabilizerness and Quantum Transport
Emanuele Tirrito | Poetri Sonya Tarabunga | Devendra Singh Bhakuni | Marcello Dalmonte | Piotr Sierant | Xhek Turkeshi
Journal article
2025
Bipolarons on dry and wet reduced rutile (110) surfaces: A constrained density functional theory study
Physical Review B (2025)
Yun-Bo Li | Da-Wei Deng | Wen-Jin Yin | Nicola Seriani | Ralph Gebauer
Preprint
2025
Dynamical Heterogeneity in Supercooled Water and its Spectroscopic Fingerprints
Cesare Malosso | Edward Danquah Donkor | Stefano Baroni | Ali Hassanali

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All publications
Preprint
2023
Entanglement-magic separation in hybrid quantum circuits
Gerald E. Fux | Emanuele Tirrito | Marcello Dalmonte | Rosario Fazio
Preprint
2023
Entanglement-magic separation in hybrid quantum circuits
Gerald E. Fux | Emanuele Tirrito | Marcello Dalmonte | Rosario Fazio
Journal article
2023
Lessons Learned from Multiobjective Automatic Optimizations of Classical Three-Site Rigid Water Models Using Microscopic and Macroscopic Target Experimental Observables
Journal of Chemical & Engineering Data (2023)
Mattia Perrone | Riccardo Capelli | Charly Empereur-mot | Ali Hassanali | Giovanni M. Pavan
Preprint
2023
Spectral properties of critical 1+1D Abelian-Higgs model
Titas Chanda | Marcello Dalmonte | Maciej Lewenstein | Jakub Zakrzewski | Luca Tagliacozzo
Journal article
2023
Dynamical Localization Transition of String Breaking in Quantum Spin Chains
Physical Review Letters (2023)
Roberto Verdel | Guo-Yi Zhu | Markus Heyl
Preprint
2023
Data-driven discovery of relevant information in quantum simulators
R. Verdel | V. Vitale | R. K. Panda | E. D. Donkor | A. Rodriguez | S. Lannig | Y. Deller | H. Strobel | M. K. Oberthaler | M. Dalmonte
Journal article
2023
The carbonyl-lock mechanism underlying non-aromatic fluorescence in biological matter
Nature Communications (2023)
Gonzalo Díaz Mirón | Jonathan A. Semelak | Luca Grisanti | Alex Rodriguez | Irene Conti | Martina Stella | Jayaramakrishnan Velusamy | Nicola Seriani | Nadja Došlić | Ivan Rivalta | Marco Garavelli | Dario A. Estrin ...
Preprint
2023
Non-parametric learning critical behavior in Ising partition functions: PCA entropy and intrinsic dimension
Rajat K. Panda | Roberto Verdel | Alex Rodriguez | Hanlin Sun | Ginestra Bianconi | Marcello Dalmonte
Journal article
2023
Ab Initio Derivation of Lattice-Gauge-Theory Dynamics for Cold Gases in Optical Lattices
PRX Quantum (2023)
Federica Maria Surace | Pierre Fromholz | Nelson Darkwah Oppong | Marcello Dalmonte | Monika Aidelsburger
Journal article
2023
Many-Body Magic Via Pauli-Markov Chains—From Criticality to Gauge Theories
PRX Quantum (2023)
Poetri Sonya Tarabunga | Emanuele Tirrito | Titas Chanda | Marcello Dalmonte
Journal article
2023
Complexity of spin configuration dynamics due to unitary evolution and periodic projective measurements
Physical Review E (2023)
Heitor P. Casagrande | Bo Xing | Marcello Dalmonte | Alex Rodriguez | Vinitha Balachandran | Dario Poletti
Journal article
2023
Self-doped p–n junctions with high carrier concentration in 2D GaN/MoSSe heterostructures: a first-principles study
Journal of Materials Chemistry A (2023)
Dawei Deng | Rutong Si | Bo Wen | Nicola Seriani | Xiao-Lin Wei | Wen-Jin Yin | Ralph Gebauer
Journal article
2023
The Oxygen Evolution Reaction at MoS2 Edge Sites: The Role of a Solvent Environment in DFT-Based Molecular Simulations
Molecules (2023)
Estefania German | Ralph Gebauer
Journal article
2023
Investigation of the effect of thermal annealing of Ni-cobaltite nanoparticles on their structure, electronic properties and performance as catalysts for the total oxidation of dimethyl ether
Catalysis Science & Technology (2023)
Daniel Onana Mevoa | Stephane Kenmoe | Muhammad Waqas | Dick Hartmann Douma | Daniel Manhouli Daawe | Katia Nchimi Nono | Ralph Gebauer | Patrick Mountapmbeme Kouotou
Journal article
2023
Zirconium Coordination Chemistry and Its Role in Optimizing Hydroxymate Chelation: Insights from Molecular Dynamics
ACS Omega (2023)
Giulia Sormani | Aruna Korde | Alex Rodriguez | Melissa Denecke | Ali Hassanali
Preprint
2023
Anatomy of the eigenstates distribution: a quest for a genuine multifractality
Anton Kutlin | Ivan M. Khaymovich
Preprint
2023
Diagrammatic method for many-body non-Markovian dynamics: memory effects and entanglement transitions
Giuliano Chiriacò | Mikheil Tsitsishvili | Dario Poletti | Rosario Fazio | Marcello Dalmonte
Journal article
2023
Free energy decompositions illuminate synergistic effects in interfacial binding thermodynamics of mixed surfactant systems
The Journal of Chemical Physics (2023)
Colin K. Egan | Ali Hassanali
Preprint
2023
Many-body magic via Pauli-Markov chains -- from criticality to gauge theories
Poetri Sonya Tarabunga | Emanuele Tirrito | Titas Chanda | Marcello Dalmonte
Preprint
2023
ZundEig: The Structure of the Proton in Liquid Water From Unsupervised Learning
The Journal of Physical Chemistry B (2023)
Solana Di Pino | Edward Danquah Donkor | Verónica M. Sánchez | Alex Rodriguez | Giuseppe Cassone | Damian Scherlis | Ali Hassanali
Preprint
2023
Non-parametric learning critical behavior in Ising partition functions: PCA entropy and intrinsic dimension
Rajat K. Panda | Roberto Verdel | Alex Rodriguez | Hanlin Sun | Ginestra Bianconi | Marcello Dalmonte
Preprint
2023
Network science Ising states of matter
Hanlin Sun | Rajat Kumar Panda | Roberto Verdel | Alex Rodriguez | Marcello Dalmonte | Ginestra Bianconi
Journal article
2023
Non-parametric learning critical behavior in Ising partition functions: PCA entropy and intrinsic dimension
Rajat K. Panda | Roberto Verdel | Alex Rodriguez | Hanlin Sun | Ginestra Bianconi | Marcello Dalmonte
Preprint
2023
Network science Ising states of matter
Hanlin Sun | Rajat Kumar Panda | Roberto Verdel | Alex Rodriguez | Marcello Dalmonte | Ginestra Bianconi
Preprint
2023
Emergence of non-Abelian SU(2) invariance in Abelian frustrated fermionic ladders
Bachana Beradze | Mikheil Tsitsishvili | Emanuele Tirrito | Marcello Dalmonte | Titas Chanda | Alexander Nersesyan
Journal article
2023
Examining the origins of observed terahertz modes from an optically pumped atomistic model protein in aqueous solution
PNAS Nexus (2023)
Khatereh Azizi | Matteo Gori | Uriel Morzan | Ali Hassanali | Philip Kurian | P Fratzl
Journal article
2023
Diverging conformations guide dipeptide self-assembly into crystals or hydrogels
Chem. Commun. (2023)
Monti, Marta | Scarel, Erica | Hassanali, Ali A. | Stener, Mauro | Marchesan, Silvia
Preprint
2023
Classification and emergence of quantum spin liquids in chiral Rydberg models
Poetri Sonya Tarabunga | Giuliano Giudici | Titas Chanda | Marcello Dalmonte
Journal article
2023
Solvation thermodynamics from cavity shapes of amino acids
PNAS Nexus (2023)
Khatereh Azizi | Alessandro Laio | Ali Hassanali | D Ramkrishna
Preprint
2023
Measurement induced transitions in non-Markovian free fermion ladders
Mikheil Tsitsishvili | Dario Poletti | Marcello Dalmonte | Giuliano Chiriacò

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