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View the latest research published by CMSP scientists.

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
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

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All publications
Journal article
2000
Oxygen configurations in silica
Physical Review B (2000)
James R. Chelikowsky | D. J. Chadi | N. Binggeli
Journal article
2000
Spin - glass transition in Kondo lattice with quenched disorder
ArXiv (2000)
Kiselev, M.N. | Oppermann, R.
Journal article
2000
Spin-glass transition in a Kondo lattice with quenched disorder
Jetp Letters (2000)
Kiselev, M. N. | Oppermann, R.
Journal article
2000
Various ordered states in a 2D interacting electron system close to an electronic topological transition
Physica B (2000)
Bouis, F. | Kiselev, M. N. | Onufrieva, F. | Pfeuty, P.
Journal article
2000
Schwinger-Keldysh semionic approach for quantum spin systems
ArXiv (2000)
Kiselev, M.N. | Oppermann, R.
Journal article
2000
Some consequences of electronic topological transition in 2D system on a square lattice: Excitonic ordered states
European Physical Journal B (2000)
Bouis, F. | Kiselev, M. | Onufrieva, F. | Pfeuty, P.
Journal article
2000
Current-voltage characteristics of NSS transistors
Physica B: Condensed Matter (2000)
Fazio, R. | Schön, G. | Siewert, J.
Journal article
2000
Leakage and fidelity of real qubits
Physica B: Condensed Matter (2000)
Fazio, R. | Palma, G.M. | Sciacca, E. | Siewert, J.
Journal article
2000
Magnons in real materials from density-functional theory
Physical Review B - Condensed Matter and Materials Physics (2000)
Gebauer, R. | Baroni, S.
Journal article
2000
Interchain electron states in polyethylene
Physical Review B-solid State (2000)
Santoro, G | Scandolo, S | Iarlori, S | Tosatti, E | Serra, S
Journal article
2000
The mechanism for the 3 x 3 distortion of Sn/Ge(111)
Surface Science (2000)
Tosatti, E | Santoro, G | Ballabio, G | Scandolo, S | de Gironcoli, S
Journal article
2000
Noncolinear spin polarization from frustrated antiferromagnetism: A possible scenario for molecular oxygen at high pressure
Physical Review B - Condensed Matter and Materials Physics (2000)
Gebauer, R. | Serra, S. | Chiarotti, G. | Scandolo, S. | Baroni, S. | Tosatti, E.
Journal article
2000
root 3X root 3R30 degrees versus adatom-rest-atom phases on (111) semiconductor surfaces
Physical Review B (2000)
Tosatti, E | Scandolo, S | Ballabio, G
Journal article
2000
Optimal basis set for electronic structure calculations in periodic systems
Physical Review B-solid State (2000)
Kohanoff, J | Scandolo, S
Journal article
2000
Physics of iron at Earth's core conditions
Science (2000)
Tosatti, E | Scandolo, S | Chiarotti, GL | Bernard, S | Laio, A
Journal article
2000
Diamonds in the sky?
Physics World (2000)
Tosatti, E | Chiarotti, G | Scandolo, S
Journal article
2000
SiC(0001): A surface Mott-Hubbard insulator
Physical Review B-solid State (2000)
Tosatti, E | Scandolo, S | Santoro, G | Korotin, MA | Bedin, AE | Anisimov, VI
Journal article
2000
Dynamical and thermal properties of polyethylene by ab initio simulation
Chemical Physics Letters (2000)
Santoro, G | Scandolo, S | Tosatti, E | Iarlori, S | Serra, S | Santoro, G | Scandolo, S | Tosatti, E | Iarlori, S | Serra, S
Journal article
2000
Spectroscopic fingerprints of a surface Mott-Hubbard insulator: the case of SiC(0001)
Surface Science (2000)
Tosatti, E | Scandolo, S | Santoro, G
Journal article
2000
Schottky barrier tuning with heterovalent interlayers: Al/Ge/GaAs versus Al/Si/GaAs
Journal of Vacuum Science and Technology B: Microelectronics and Nanometer Structures (2000)
Berthod, C. | Binggeli, N. | Baldereschi, A.
Journal article
2000
Work-function anisotropy in noble metals: Contributions from d states and effects of the surface atomic structure
Physical Review B - Condensed Matter and Materials Physics (2000)
Fall, C. | Binggeli, N. | Baldereschi, A.
Journal article
2000
Existence of localized interface states in metal/GaAs(100) junctions: Au versus Al contacts
Physical Review B - Condensed Matter and Materials Physics (2000)
Bardi, J. | Binggeli, N. | Baldereschi, A.
Journal article
2000
Koster-Slater model for the interface-state problem
Physical Review B - Condensed Matter and Materials Physics (2000)
Di Ventra, M. | Berthod, C. | Binggeli, N.
Journal article
2000
Pressure-induced amorphization in crystalline silica: Soft phonon modes and shear instabilities in coesite
Physical Review B - Condensed Matter and Materials Physics (2000)
Dean, D.W. | Wentzcovitch, R.M. | Keskar, N. | Chelikowsky, J.R. | Binggeli, N.
Journal article
2000
How the next-nearest-neighbor interactions change the phase diagram of a fully frustrated XY model?
Physica B (2000)
Cataudella, V | Franzese, G | Korshunov, SE | Fazio, R
Journal article
2000
Aspects of qubit dynamics in the presence of leakage
Journal of Low Temperature Physics (2000)
Siewert, J | Fazio, R | Palma, GM | Sciacca, E
Journal article
2000
Re-entrant spin susceptibility of a superconducting grain
Physical Review Letters (2000)
Di Lorenzo, A | Fazio, R | Hekking, FWJ | Falci, G | Mastellone, A | Giaquinta, G
Journal article
2000
Coherence between superconducting edge states in superconducting periodic arrays of artificial defects
Journal of Low Temperature Physics (2000)
Abilio, CC | Amico, L | Fazio, R | Pannetier, B
Journal article
2000
Thermodynamic and spectral properties of ultrasmall superconducting grains
Journal of Low Temperature Physics (2000)
Falci, G | Fazio, R | Hekking, FWJ | Mastellone, A
Journal article
2000
Detection of geometric phases in superconducting nanocircuits
Nature (2000)
Falci, G | Fazio, R | Palma, GM | Siewert, J | Vedral, V

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