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445 results: 445 articles and 0 books or book chapters
Last updated: Nov 05, 2025-
181
A comprehensive study on A2PdH2: from ambient to
high pressure
Z. Alizadeh, Y. -W. Fang, I. Errea, and M. R. Mohammadizadeh
J. Mater. Chem. C , (2025). -
182
Optical and excitonic properties of calcite CaCO3
J. Janovec, J. S. Dolado, and A. Ayuela
J. Mater. Chem. C 13, 6267 (2025). -
183
Thermodynamic model for the structure of Nd doped phosphate laser
glasses and the neodymium chemistry influence on their emission
properties
A. Lopez-Grande, J. Azkargorta, I. Iparraguirre, G. Tricot, S. Garcia-Revilla, J. Fernandez, R. Balda, and F. Munoz
J. Non-Cryst. Solids 668, 123779 (2025). -
184
Computational analysis of the Lewis acid-catalyzed zwitterionic ring-expansion polymerization (ZREP) of monosubstituted ethylene oxide
X. Gastearena, F. Barroso-Bujans, F. Ruiperez, and J. M. Matxain
J. Org. Chem. 90, 2592 (2025). -
185
Mechanistic insights into copper-catalyzed alkene aminofluorination and rational design of a metal-free strategy
Y. Zhang, S. Zhang, J. Xu, S. Ge, S. Sun, G. Frenking, and L. Zhao
J. Org. Chem. 90, 8601 (2025). -
186
Toward a systematics for the lowest excited states of heteroaromatics enabled via cyclic π-conjugated carbenes and heteroelement analogues
N. P. Vedin, J. M. Toldo, S. Escayola, S. Radenkovic, M. Sola, and H. Ottosson
J. Org. Chem. 90, 9743 (2025). -
187
Ru-Sn and Ru-Os mixed-metal clusters bearing heterocyclic thiolate
ligand(s): Synthesis, crystal and electronic structures
M. M. Hossain, V. N. Nesterov, G. Hogarth, G. E. Pieslinger, S. E. Kabir, and S. Ghosh
J. Organomet. Chem. 1031, 123593 (2025). -
188
Origins of the anomalous Hall conductivity in the symmetry enforced
Fe3GeTe2 nodal-line ferromagnet
M. Garcia-Diez, H. Beidenkopf, I. Robredo, and M. G. Vergniory
J. Phys-Mater. 8, 035012 (2025). -
189
Artificial intelligence for advanced functional materials: exploring
current and future directions
C. Malica, K. S. Novoselov, A. S. Barnard, V. Kalinin, S. R. Spurgeon, K. Reuter, M. Alducin, V. L. Deringer, G. Csanyi, N. Marzari, S. Huang, G. Cuniberti, Q. Deng, P. Ordejon, I. Cole, K. Choudhary, K. Hippalgaonkar, R. Zhu, O. A. von Lilienfeld, M. Hibat-Allah, et al.
J. Phys-Mater. 8, 021001 (2025). -
190
Oligothiophene-based photovoltaic materials for organic solar cells: Exciton properties by the CNDOL Fockian approach
A. Guerra-Barroso, Y. Perez-Badell, A. L. Montero-Alejo, and L. A. Montero-Cabrera
J. Phys. Chem. A 129, 3202 (2025). -
191
The electron−phonon interaction at the (110) surface of hydrogen covered Mo1−xRex alloys from helium atom scattering
Giorgio Benedek, Björn Flach, Joseph R. Manson, Salvador Miret-Artés, and J. Peter Toennies
J. Phys. Chem. C 129, 17632 (2025). -
192
The electron-phonon interaction at the (110) surface of hydrogen-covered Mo1-x Re x alloys from helium atom scattering
G. Benedek, B. Flach, J. R. Manson, S. Miret-Artes, and J. P. Toennies
J. Phys. Chem. C 129, 17632 (2025). -
193
Second harmonic response of azobenzene self-assembled monolayers: the effect of push/pull substitution
A. Dellai, L. Muccioli, F. Castet, and C. Tonnele
J. Phys. Chem. C 129, 8417 (2025). -
194
Semianalytical treatment of collective vibrational strong coupling in infrared phononic and plasmonic nanoantennas
J. Sepulveda, J. L. Montano-Priede, J. Aizpurua, and R. Esteban
J. Phys. Chem. C 129, 12374 (2025). -
195
Exciton properties and broadband emission in two-dimensional Ruddlesden-Popper perovskites
J. Tan, X. Jiang, D. Liu, Z. -K. Tang, E. V. Chulkov, and A. S. Vasenko
J. Phys. Chem. Lett. 16, 7659 (2025). -
196
Anharmonic motion-induced self-passivation of hydrogen defects in hybrid organic-inorganic perovskites: Ab initio quantum dynamics
X. Tian, A. S. Vasenko, E. V. Chulkov, and R. Long
J. Phys. Chem. Lett. 16, 10466 (2025). -
197
Molecular derailment via pressurization in methylammonium lead iodide
P. Marin-Villa, P. Gila-Herranz, M. Jimenez-Ruiz, A. Ivanov, J. Armstrong, K. Druzbicki, and F. Fernandez-Alonso
J. Phys. Chem. Lett. 16, 10906 (2025). -
198
Highly oriented nitrogen-doped flower-like ZnO nanostructures for boosting photocatalytic and photoelectrochemical performance: a combined experimental and DFT study
R. R. Wary, A. Das, E. S. Amirov, D. Liu, S. Gumber, E. A. Kazakova, A. S. Vasenko, and O. V. Prezhdo
J. Phys. Chem. Lett. 16, 5180 (2025). -
199
Ab Initio atomistic characterization of confined bulk and Bennett plasmons in metallic nanoparticles as probed by penetrating electrons
B. Candelas, M. Urbieta, A. Babaze, E. Ogando, A. G. Borisov, N. Zabala, and J. Aizpurua
J. Phys. Chem. Lett. 16, 2965 (2025). -
200
Optical addressability of the arylnitrene spin triplet
G. Ricci, C. Tonnele, and D. Casanova
J. Phys. Chem. Lett. 16, 5659 (2025).