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View the latest research published by CMSP scientists.

Journal article
2025
Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations
The Journal of Physical Chemistry A (2025)
B. Hourahine | M. Berdakin | J. A. Bich | F. P. Bonafé | C. Camacho | Q. Cui | M. Y. Deshaye | G. Díaz Mirón | S. Ehlert | M. Elstner | T. Frauenheim | N. Goldman | R. A. González León | T. van der Heide | S. Irle ...
Journal article
2025
Crystallization of L‐Cysteine in Heavy Water Induces Intrinsic Fluorescence
Angewandte Chemie (2025)
Debarshi Banerjee | Sonika Chibh | Om Shanker Tiwari | Gonzalo Díaz Mirón | Marta Monti | Hadar R. Yakir | Shweta Pawar | Dror Fixler | Linda J. W. Shimon | Ehud Gazit | Ali Hassanali
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
Interplay of entanglement structures and stabilizer entropy in spin models
Michele Viscardi | Marcello Dalmonte | Alioscia Hamma | Emanuele Tirrito
Journal article
2025
Monitored long-range interacting systems: spin-wave theory for quantum trajectories
Nature Communications (2025)
Zejian Li | Anna Delmonte | Xhek Turkeshi | Rosario Fazio
Journal article
2025
Computational Simulations and Strategies for Optimal Hydrogen Storage Materials Design
PRX Energy (2025)
Vikram Mahamiya | Alok Shukla | Abhishek Kumar Adak | Hoonkyung Lee | Nicola Seriani | Ralph Gebauer
Preprint
2025
Chiral Gravitons on the Lattice
Hernan B. Xavier | Zeno Bacciconi | Titas Chanda | Dam Thanh Son | Marcello Dalmonte
Preprint
2025
Family-Vicsek universality of the binary intrinsic dimension of nonequilibrium data
Roberto Verdel | Devendra Singh Bhakuni | Santiago Acevedo
Journal article
2025
Data-Driven Discovery of the Origins of UV Absorption in the Alpha-3C Protein
The Journal of Physical Chemistry B (2025)
Germaine Neza Hozana | Gonzalo Díaz Mirón | Ali Hassanali
Preprint
2025
Local vs non-local dynamics in cavity-coupled Rydberg atom arrays
Zeno Bacciconi | Hernan B. Xavier | Matteo Marinelli | Devendra Singh Bhakuni | Marcello Dalmonte
Journal article
2025
Measurement-induced phase transitions in monitored infinite-range interacting systems
Physical Review Research (2025)
Anna Delmonte | Zejian Li | Gianluca Passarelli | Eric Yilun Song | Diego Barberena | Ana Maria Rey | Rosario Fazio
Journal article
2025
Breaking of Lorentz invariance caused by the interplay between spin-orbit interaction and transverse phonon modes in quantum wires
Physical Review Research (2025)
D. V. Efremov | Weyner Ccuiro | Luis E. F. Foa Torres | M. N. Kiselev

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All publications
Journal article
2010
Velocity-modulation control of electron-wave propagation in graphene
Physical Review B (2010)
Raoux, Arnaud | Polini, Marco | Asgari, Reza | Hamilton, A. R. | Fazio, Rosario | MacDonald, A. H.
Journal article
2010
Homogeneous binary trees as ground states of quantum critical Hamiltonians
Physical Review a (2010)
Silvi, P. | Giovannetti, V. | Montangero, S. | Rizzi, M. | Cirac, J. I. | Fazio, R.
Journal article
2010
Coherent Detection of Electron Dephasing
Physical Review Letters (2010)
Strambini, E. | Chirolli, L. | Giovannetti, V. | Taddei, F. | Fazio, R. | Piazza, V. | Beltram, F.
Journal article
2010
Homogeneous multiscale entanglement renormalization ansatz tensor networks for quantum critical systems
New Journal of Physics (2010)
Rizzi, M. | Montangero, S. | Silvi, P. | Giovannetti, V. | Fazio, Rosario
Journal article
2010
Dynamical Phase Transitions and Instabilities in Open Atomic Many-Body Systems
Physical Review Letters (2010)
Diehl, Sebastian | Tomadin, Andrea | Micheli, Andrea | Fazio, Rosario | Zoller, Peter
Journal article
2010
Many-body phenomena in QED-cavity arrays
Journal of the Optical Society of America B-Optical Physics (2010)
Tomadin, A. | Fazio, Rosario
Journal article
2010
Electron-electron interactions in decoupled graphene layers
Physical Review B (2010)
Profumo, Rosario E. V. | Polini, Marco | Asgari, Reza | Fazio, Rosario | MacDonald, A. H.
Journal article
2009
Effects of chemical order and atomic relaxation on the electronic and magnetic properties of La 2/3 Sr 1/3 MnO 3
Journal of Physics Condensed Matter (2009)
Zheng, B. | Binggeli, N.
Journal article
2009
Mesoscopic donor - Acceptor multilayer by ultrahigh-vacuum codeposition of Zn-tetraphenyl-porphyrin and C70
Journal of the American Chemical Society (2009)
Vilmercati, P. | Castellarin-Cudia, C. | Gebauer, R. | Ghosh, P. | Lizzit, S. | Petaccia, L. | Cepek, C. | Larciprete, R. | Verdini, A. | Floreanos, L. | Morgante, A. | Goldoni, A.
Journal article
2009
Atomic color superfluid via three-body loss
Physical review letters (2009)
Marcello Dalmonte
Journal article
2009
Quantum tunneling through moving Kondo objects
Physica Status Solidi (C) Current Topics in Solid State Physics (2009)
Kikoin, Konstantin | Kiselev, Michael N. | Richert, Jean
Journal article
2009
Spin and charge necklaces at commensurate filling
25TH INTERNATIONAL CONFERENCE ON LOW TEMPERATURE PHYSICS (LT25), PART 4 (2009)
Mikhail Kiselev
Journal article
2009
Kondo effect in Complex Quantum Dots in the presence of an oscillating and fluctuating gate signal
ArXiv (2009)
Kiselev, M.N. | Kikoin, K. | Richert, J.
Journal article
2009
Scalar and vector Keldysh models in the time domain
ArXiv (2009)
Kiselev, M.N. | Kikoin, K.
Journal article
2009
Magnetism and vibrations in the phase ε{lunate} of oxygen
Solid State Communications (2009)
Anh Pham, T. | Gebauer, R. | Scandolo, S.
Journal article
2009
Mesoscopic donor - Acceptor multilayer by ultrahigh-vacuum codeposition of Zn-tetraphenyl-porphyrin and C<inf>70</inf>
Journal of the American Chemical Society (2009)
Vilmercati, P. | Castellarin-Cudia, C. | Gebauer, R. | Ghosh, P. | Lizzit, S. | Petaccia, L. | Cepek, C. | Larciprete, R. | Verdini, A. | Floreanos, L. | Morgante, A. | Goldoni, A.
Journal article
2009
Polymerization effects and localized electronic states in condensed-phase eumelanin
Physical Review B - Condensed Matter and Materials Physics (2009)
Sangaletti, L. | Borghetti, P. | Ghosh, P. | Pagliara, S. | Vilmercati, P. | Castellarin-Cudia, C. | Floreano, L. | Cossaro, A. | Verdini, A. | Gebauer, R. | Goldoni, A.
Journal article
2009
Time-dependent density functional theory study of squaraine dye-sensitized solar cells
Chemical Physics Letters (2009)
Rocca, D. | Gebauer, R. | De Angelis, F. | Nazeeruddin, M.K. | Baroni, S.
Journal article
2009
Statistical properties of determinantal point processes in high-dimensional Euclidean spaces
Physical Review E - Statistical, Nonlinear, and Soft Matter Physics (2009)
Scardicchio, A. | Zachary, C.E. | Torquato, S.
Journal article
2009
Index Distribution of Gaussian Random Matrices
Physical Review Letters (2009)
Majumdar, S.N. | Nadal, C. | Scardicchio, A. | Vivo, P.
Journal article
2009
Quantum Zeno effect in a model multilevel molecule
Journal of Physical Chemistry A (2009)
Bruno, D. | Facchi, P. | Longo, S. | Minelli, P. | Pascazio, S. | Scardicchio, A.
Journal article
2009
Infrared absorption of MgO at high pressures and temperatures: A molecular dynamic study
The Journal of Chemical Physics (2009)
Scandolo, Sandro | Miranda, Caetano R. | Liang, Yunfeng | Adebayo, Gboyega A.
Journal article
2009
Magnetism and vibrations in the phase epsilon of oxygen
Solid State Communications (2009)
Scandolo, S. | Gebauer, R. | Pham, T. Anh
Journal article
2009
A Dynamic Landscape from Femtoseconds to Minutes for Excess Electrons at Ice-Metal Interfaces
The Journal of Physical Chemistry C (2009)
Wolf, M. | Rubio, A. | Zhu, X. -Y. | Scandolo, S. | Baletto, F. | Meyer, M. | Bockstedte, M. | Staehler, J. | Gahl, C. | Bovensiepen, U.
Journal article
2009
Melting slope of MgO from molecular dynamics and density functional theory
The Journal of Chemical Physics (2009)
Scandolo, Sandro | Tangney, Paul
Journal article
2009
Ab initio pseudopotential study of vacancies and self-interstitials in hcp titanium
Philosophical Magazine (2009)
Britton, David Thomas | Haerting, Margit | Nsengiyumva, Schadrack | Mazzarello, Riccardo | Scandolo, Sandro | Raji, Abdulrafiu Tunde
Journal article
2009
QUANTUM ESPRESSO: A modular and open-source software project for quantum simulations of materials
Journal of Physics Condensed Matter (2009)
Giannozzi, P. | Baroni, S. | Bonini, N. | Calandra, M. | Car, R. | Cavazzoni, C. | Ceresoli, D. | Chiarotti, G.L. | Cococcioni, M. | Dabo, I. | Dal Corso, A. | De Gironcoli, S. | Fabris, S. | Fratesi, G. | Gebauer, R. ...
Journal article
2009
Ab initio study of Kr in hcp Ti: Diffusion, formation and stability of small Kr-vacancy clusters
Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms (2009)
Britton, D. T. | Haerting, M. | Nsengiyumva, S. | Mazzarello, R. | Scandolo, S. | Raji, A. T.
Journal article
2009
Thermodynamic stability of layered structures in compressed CO2
Physical Review B (2009)
Scandolo, Sandro | Montoya, Javier A. | Lee, Mal-Soon
Journal article
2009
High-pressure polymeric phases of carbon dioxide
Proceedings of the National Academy of Sciences (2009)
Tosatti, Erio | Scandolo, Sandro | Lee, Mal-Soon | Montoya, Javier Antonio | Martonak, Roman | Klug, Dennis D. | Sun, Jian

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