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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

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

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

Glassy Arrest Behind the Apparent Second Liquid in Water

Florian Pabst | Ali Hassanali

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All publications

Journal article

2015

Nanoscale Mach-Zehnder interferometer with spin-resolved quantum Hall edge states

Physical Review B (2015)

Karmakar, Biswajit | Venturelli, Davide | Chirolli, Luca | Giovannetti, Vittorio | Fazio, Rosario | Roddaro, Stefano | Pfeiffer, Loren N. | West, Ken W. | Taddei, Fabio | Pellegrini, Vittorio

Journal article

2015

Efficiency of quantum controlled non-Markovian thermalization

New Journal of Physics (2015)

Mukherjee, V. | Giovannetti, V. | Fazio, R. | Huelga, S. F. | Calarco, T. | Montangero, S.

Journal article

2015

Thermalization in a periodically driven fully connected quantum Ising ferromagnet

Epl (2015)

Russomanno, Angelo | Fazio, Rosario | Santoro, Giuseppe E.

Journal article

2015

Nonequilibrium fluctuations in quantum heat engines: theory, example, and possible solid state experiments

New Journal of Physics (2015)

Campisi, Michele | Pekola, Jukka | Fazio, Rosario

Journal article

2015

Localized Majorana-Like Modes in a Number-Conserving Setting: An Exactly Solvable Model

Physical Review Letters (2015)

Iemini, Fernando | Mazza, Leonardo | Rossini, Davide | Fazio, Rosario | Diehl, Sebastian

Journal article

2015

Thermopower of three-terminal topological superconducting systems

Physical Review B (2015)

Valentini, Stefano | Fazio, Rosario | Giovannetti, Vittorio | Taddei, Fabio

Journal article

2015

Photon transport in a dissipative chain of nonlinear cavities

Physical Review a (2015)

Biella, Alberto | Mazza, Leonardo | Carusotto, Iacopo | Rossini, Davide | Fazio, Rosario

Journal article

2015

Magnetic crystals and helical liquids in alkaline-earth fermionic gases

Nature Communications (2015)

Barbarino, Simone | Taddia, Luca | Rossini, Davide | Mazza, Leonardo | Fazio, Rosario

Journal article

2014

Defective α-Fe2O3(0001): An ab Initio Study

ChemPhysChem (2014)

Nguyen, M.-T. | Seriani, N. | Gebauer, R.

Journal article

2014

Photo-driven oxidation of water on α-Fe2O3 surfaces: An ab initio study

Journal of Chemical Physics (2014)

Nguyen, M.-T. | Seriani, N. | Piccinin, S. | Gebauer, R.

Journal article

2014

Quantum Spin-Ice and Dimer Models with Rydberg Atoms

Physical Review X (2014)

Marcello Dalmonte

Preprint

2014

Designing Frustrated Quantum Magnets with Laser-Dressed Rydberg Atoms

Physical Review Letters (2014)

Alexander W. Glaetzle | Marcello Dalmonte | Rejish Nath | Christian Gross | Immanuel Bloch | Peter Zoller

Preprint

2014

turboTDDFT 2.0 - Hybrid functionals and new algorithms within time-dependent density-functional perturbation theory

Xiaochuan Ge | Simon J. Binnie | Dario Rocca | Ralph Gebauer | Stefano Baroni

Preprint

2014

Gap scaling at Berezinskii-Kosterlitz-Thouless quantum critical points in one-dimensional Hubbard and Heisenberg models

Physical Review B (2014)

M. Dalmonte | J. Carrasquilla | L. Taddia | E. Ercolessi | M. Rigol

Preprint

2014

Quantum Spin Ice and dimer models with Rydberg atoms

Alexander W. Glaetzle | Marcello Dalmonte | Rejish Nath | Ioannis Rousochatzakis | Roderich Moessner | Peter Zoller

Journal article

2014

Spin-polarization properties and electronic structure of the ordered c(2 × 2) MnCu/Cu(1 1 0) surface alloy

Journal of Physics: Condensed Matter (2014)

C Wang | N Stojić | N Binggeli

Journal article

2014

Equilibrium Fermi-liquid coefficients for the fully screened N-channel Kondo model

Physical Review B (2014)

Hanl, M. | Weichselbaum, A. | von Delft, J. | Kiselev, M.

Journal article

2014

Critical Exponents of the Superfluid-Bose-Glass Transition in Three Dimensions

Physical Review Letters (2014)

Yao, Zhiyuan | da Costa, Karine P. C. | Kiselev, Mikhail | Prokof'ev, Nikolay

Journal article

2014

Electronic spin working mechanically

Low Temperature Physics (2014)

Shekhter, R. I. | Gorelik, L. Y. | Krive, I. V. | Kiselev, M. N. | Kulinich, S. I. | Parafilo, A. V. | Kikoin, K. | Jonson, M.

Journal article

2014

Quench dynamics of a disordered array of dissipative coupled cavities

Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences (2014)

Creatore, C. | Fazio, R. | Keeling, J. | Türeci, H.E.

Journal article

2014

The role of quantum effects on structural and electronic fluctuations in neat and charged water.

The journal of physical chemistry. B (2014)

Giberti F | Hassanali AA | Ceriotti M | Parrinello M

Journal article

2014

Anomalous water diffusion in salt solutions.

Proceedings of the National Academy of Sciences of the United States of America (2014)

Ding Y | Hassanali AA | Parrinello M

Journal article

2014

Aqueous solutions: state of the art in ab initio molecular dynamics.

Philosophical transactions. Series A, Mathematical, physical, and engineering sciences (2014)

Hassanali AA | Cuny J | Verdolino V | Parrinello M

Journal article

2014

Ab initio molecular dynamics study of the mechanism of proton recombination with a weak base.

The journal of physical chemistry. B (2014)

Cuny J | Hassanali AA

Journal article

2014

TurboTDDFT 2.0 - Hybrid functionals and new algorithms within time-dependent density-functional perturbation theory

Computer Physics Communications (2014)

Ge, X. | Binnie, S.J. | Rocca, D. | Gebauer, R. | Baroni, S.

Journal article

2014

Defective α-Fe<inf>2</inf>O<inf>3</inf>(0001): An ab Initio Study

ChemPhysChem (2014)

Nguyen, M.-T. | Seriani, N. | Gebauer, R.

Journal article

2014

Graphene supported on hematite surfaces: A density functional study

Journal of Physical Chemistry C (2014)

Nguyen, M.-T. | Gebauer, R.

Journal article

2014

Photo-driven oxidation of water on α-Fe<inf>2</inf>O<inf>3</inf> surfaces: An ab initio study

Journal of Chemical Physics (2014)

Nguyen, M.-T. | Seriani, N. | Piccinin, S. | Gebauer, R.

Journal article

2014

Anderson localization on the Bethe lattice: Nonergodicity of extended states

Physical Review Letters (2014)

De Luca, A. | Altshuler, B.L. | Kravtsov, V.E. | Scardicchio, A.

Journal article

2014

Holographic superconductor with disorder

Physical Review D - Particles, Fields, Gravitation and Cosmology (2014)

Areán, D. | Farahi, A. | Pando Zayas, L.A. | Landea, I.S. | Scardicchio, A.

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