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515 results: 515 articles and 0 books or book chapters
Last updated: 2023/05/11-
201
Photoinduced CO desorption dominates over oxidation on different O + CO covered Ru(0001) surfaces
A. Tetenoire, J. I. Juaristi, and M. Alducin
J. Phys. Chem. C 127, 10087 (2023). -
202
Thermal with electronic excitation for the unidirectional rotation of a molecule on a surface
K. H. Au-Yeung, S. Sarkar, T. Kuehne, O. Aiboudi, D. A. Ryndyk, R. Robles, F. Lissel, N. Lorente, C. Joachim, and F. Moresco
J. Phys. Chem. C 127, 16989 (2023). -
203
Theoretical elastic constants of tobermorite enhanced with reduced graphene oxide through hydroxyl vs epoxy functionalization: a first-principles study
M. Izadifar, J. S. Dolado, P. Thissen, N. Ukrainczyk, E. Koenders, and A. Ayuela
J. Phys. Chem. C 127, 18117 (2023). -
204
Stable room temperature nitrenes created by photolysis of crystalline 4-azido-2,3,5,6-tetrafluorobenzoic acid
T. J. Gately, R. A. Boto, M. J. Tauber, D. Casanova, and C. J. Bardeen
J. Phys. Chem. C 127, 4816 (2023). -
205
Molecular doping in the organic semiconductor diindenoperylene: insights from many-body perturbation theory
M. Mansouri, P. Koval, S. Sharifzadeh, and D. Sanchez-Portal
J. Phys. Chem. C 127, 16668 (2023). -
206
Steering on-surface reactions by kinetic and thermodynamic strategies
T. Wang, Q. Fan, and J. Zhu
J. Phys. Chem. Lett. 14, 2251 (2023). -
207
Chiral-induced spin selectivity and non-equilibrium spin accumulation in molecules and interfaces: a first-principles study
S. Naskar, V. Mujica, and C. Herrmann
J. Phys. Chem. Lett. 14, 694 (2023). -
208
From solution to surface: persistence of the diradical character of a diindenoanthracene derivative on a metallic substrate
J. Hieulle, C. Garcia Fernandez, N. Friedrich, A. Vegliante, S. Sanz, D. Sanchez-Portal, M. M. Haley, J. Casado, T. Frederiksen, and J. I. Pascual
J. Phys. Chem. Lett. 14, 11506 (2023). -
209
Mn-Modified ZnO nanoflakes for optimal photoelectrochemical performance under visible light: experimental design and theoretical rationalization
A. Das, D. Liu, R. R. Wary, A. S. Vasenko, O. V. Prezhdo, and R. G. Nair
J. Phys. Chem. Lett. 14, 9604 (2023). -
210
Electrical discharge in a cavitating liquid under an ultrasound field
T. Karabassov, A. S. Vasenko, V. M. Bayazitov, A. A. Golubov, I. S. Fedulov, and A. V. Abramova
J. Phys. Chem. Lett. 14, 10880 (2023). -
211
Room-temperature C-C sigma-bond activation of biphenylene derivatives on Cu(111)
J. P. Calupitan, T. Wang, A. P. Paz, B. Alvarez, A. Berdonces-Layunta, P. Angulo-Portugal, R. Castrillo-Bodero, F. Schiller, D. Pena, M. Corso, D. Perez, and D. G. de Oteyza
J. Phys. Chem. Lett. 14, 947 (2023). -
212
Chiral and catalytic effects of site-specific molecular adsorption
B. Borca, T. Michnowicz, F. Aguilar-Galindo, R. Petuya, M. Pristl, V. Schendel, I. Pentegov, U. Kraft, H. Klauk, P. Wahl, A. Arnau, and U. Schlickum
J. Phys. Chem. Lett. 14, 2072 (2023). -
213
How adsorbed oxygen atoms inhibit hydrogen dissociation on tungsten surfaces
A. Rodriguez-Fernandez, L. Bonnet, P. Larregaray, and R. D. Muino
J. Phys. Chem. Lett. 14, 1246 (2023). -
214
Insight into the temperature-dependent canting of 4f magnetic moments from 4f photoemission
D. Y. Usachov, A. V. Tarasov, D. Glazkova, M. Mende, S. Schulz, G. Poelchen, A. V. Fedorov, O. Y. Vilkov, K. A. Bokai, V. S. Stolyarov, K. Kliemt, C. Krellner, and D. V. Vyalikh
J. Phys. Chem. Lett. 14, 5537 (2023). -
215
Efficient modeling of quantum dynamics of charge carriers in materials using short nonequilibrium molecular dynamics
B. Wang, Y. Wu, D. Liu, A. S. Vasenko, D. Casanova, and O. V. Prezhdo
J. Phys. Chem. Lett. 14, 8289 (2023). -
216
Unusual low-energy collective charge excitations in high-Tc cuprate superconductors
V. M. Silkin, S. -L. Drechsler, and D. V. Efremov
J. Phys. Chem. Lett. 14, 8060 (2023). -
217
Adsorption of silanediol-like molecules on TiO2 nano-clusters: a density-functional-theoretic study
F. Aguilera-Granja, R. H. Aguilera-del-Toro, E. E. Vogel, and J. Escrig
J. Phys. Chem. Solids 183, 111642 (2023). -
218
Deciphering the role of (anti)aromaticity in cofacial excimers of linear
acenes
A. Krishnan, A. Diaz-Andres, K. P. Sudhakaran, A. T. John, M. Hariharan, and D. Casanova
J. Phys. Org. Chem. 36, e4438 (2023). -
219
In the quest of Huckel-Huckel and Huckel-Baird double aromatic tropylium(tri)cation and anion derivatives
S. Escayola, N. P. Vedin, A. Poater, H. Ottosson, and M. Sola
J. Phys. Org. Chem. 36, e4447 (2023). -
220
Mach-Zehnder-like interferometry with graphene nanoribbon networks
S. Sanz, N. Papior, G. Giedke, D. Sanchez-Portal, M. Brandbyge, and T. Frederiksen
J. Phys.-Condes. Matter 35, 374001 (2023).