Rossi group

Publications

Tips on using this search form

  • All search terms are case-insensitive
  • If you specify more than one search option (e.g. you search for both "Authors" and "Paper title") then the publications returned will be those that match all of your search terms
  • To reset the search form, click here
  • Currently displaying 101 - 120 of 174 publications
Author(s)
Publication title
Journal Name
Publication year
Quantum Nuclei at Weakly Bonded Interfaces: The Case of Cyclohexane on Rh(111)
K Fidanyan, I Hamada, M Rossi
Advanced Theory and Simulations
(2021)
4
(doi: 10.1002/adts.202000241)
Plasmonic enhancement of molecular hydrogen dissociation on metallic magnesium nanoclusters.
OA Douglas-Gallardo, CL Box, RJ Maurer
Nanoscale
(2021)
13
(doi: 10.1039/d1nr02033a)
Cover Image, Volume 121, Issue 3
D Maksimov, C Baldauf, M Rossi
International Journal of Quantum Chemistry
(2020)
121
(doi: 10.1002/qua.26284)
Germany’s Future in Theoretical and Computational Chemistry: a Special Issue Celebrating DEAL
C König, V Krewald, M Roemelt, M Rossi
International Journal of Quantum Chemistry
(2020)
121
(doi: 10.1002/qua.26587)
Determining the Effect of Hot Electron Dissipation on Molecular Scattering Experiments at Metal Surfaces
CL Box, Y Zhang, R Yin, B Jiang, RJ Maurer
JACS Au
(2020)
1
(doi: 10.1021/jacsau.0c00066)
Nuclear dynamics of singlet exciton fission: a direct observation in pentacene single crystals
H Seiler, M Krynski, D Zahn, S Hammer, YW Windsor, T Vasileiadis, J Pflaum, R Ernstorfer, M Rossi, H Schwoerer
(2020)
Multidimensional Hydrogen Tunneling in Supported Molecular Switches: The Role of Surface Interactions
Y Litman, M Rossi
Phys Rev Lett
(2020)
125
(doi: 10.1103/PhysRevLett.125.216001)
Pentacene and tetracene molecules and films on H/Si(111): level alignment from hybrid density functional theory
SM Janke, M Rossi, SV Levchenko, S Kokott, M Scheffler, V Blum
Electronic Structure
(2020)
2
(doi: 10.1088/2516-1075/ab9bb5)
The conformational space of a flexible amino acid at metallic surfaces
D Maksimov, C Baldauf, M Rossi
International Journal of Quantum Chemistry
(2020)
121
(doi: 10.1002/qua.26369)
Multidimensional Hydrogen Tunneling in Supported Molecular Switches: The Role of Surface Interactions
Y Litman, M Rossi
(2020)
The Conformational Space of a Flexible Amino Acid at Metallic Surfaces
D Maksimov, C Baldauf, M Rossi
(2020)
Ultrafast charge transfer and vibronic coupling in a laser-excited hybrid inorganic/organic interface
M Jacobs, J Krumland, AM Valencia, H Wang, M Rossi, C Cocchi
Advances in Physics X
(2020)
5
(doi: 10.1080/23746149.2020.1749883)
Pentacene and Tetracene Molecules and Films on H/Si(111): Level Alignment from Hybrid Density Functional Theory
SM Janke, M Rossi, SV Levchenko, S Kokott, M Scheffler, V Blum
(2020)
Ultrafast charge transfer and vibronic coupling in a laser-excited hybrid inorganic/organic interface
M Jacobs, J Krumland, AM Valencia, H Wang, M Rossi, C Cocchi
(2020)
Emerging opportunities and future directions: general discussion.
SC Althorpe, W Barford, J Blumberger, C Bungey, I Burghardt, A Datta, S Ghosh, S Giannini, T Grünbaum, S Habershon, S Hammes-Schiffer, S Hay, S Iyengar, G Jones, A Kelly, K Komarova, J Lawrence, Y Litman, J Mannouch, D Manolopoulos, C Martens, RJ Maurer, M Melander, M Rossi, K Sakaushi, M Saller, A Schile, S Sturniolo, G Trenins, G Worth
Faraday Discuss
(2020)
221
(doi: 10.1039/C9FD90077B)
Zero-point energy and tunnelling: General discussion
SC Althorpe, AM Alvertis, W Barford, RL Benson, I Burghardt, S Giannini, S Habershon, S Hammes-Schiffer, S Hay, S Iyengar, A Kelly, K Komarova, J Lawrence, Y Litman, C Martens, RJ Maurer, D Plant, M Rossi, K Sakaushi, A Schile, S Sturniolo, DP Tew, G Trenins, G Worth
Faraday discussions
(2020)
221
(doi: 10.1039/C9FD90075F)
Temperature dependence of the vibrational spectrum of porphycene: a qualitative failure of classical-nuclei molecular dynamics.
Y Litman, J Behler, M Rossi
Faraday Discussions
(2020)
221
(doi: 10.1039/c9fd00056a)
Using Gaussian process regression to simulate the vibrational Raman spectra of molecular crystals
N Raimbault, A Grisafi, M Ceriotti, M Rossi
New Journal of Physics
(2019)
21
(doi: 10.1088/1367-2630/ab4509)
Assessment of Approximate Methods for Anharmonic Free Energies.
V Kapil, E Engel, M Rossi, M Ceriotti
Journal of chemical theory and computation
(2019)
15
(doi: 10.1021/acs.jctc.9b00596)
Using Gaussian Process Regression to Simulate the Vibrational Raman Spectra of Molecular Crystals
N Raimbault, A Grisafi, M Ceriotti, M Rossi
(2019)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
Contacts
Directions

Privacy and cookie policy

About the Department

Departmental Services

Study at Cambridge

About the University

Research at Cambridge