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6915 results: 6877 articles and 38 books or book chapters
Last updated: 29/12/2025-
221
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). -
222
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). -
223
Assessing second-order perturbative corrections to restricted active space CI for valence excitations in organic molecules
J. B. Perumal Marisami, and D. Casanova
J. Phys. Chem. A 129, 11736 (2025). -
224
A-H•••π Hydrogen bonds - Where are proton acceptor sites located?
S. J. Grabowski
J. Phys. Chem. A 129, 11650 (2025). -
225
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). -
226
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). -
227
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). -
228
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). -
229
Hydrogen disproportionation reduces the bandgap and prolongs the carrier lifetime in Cs2AgBiBr6: Quantum dynamics analysis
E. S. Amirov, D. Liu, M. R. Samatov, D. A. Abrameshin, A. E. Abrameshin, A. S. Kramarenko, P. A. Troshin, W. Chu, H. Zhou, A. S. Vasenko, and O. V. Prezhdo
J. Phys. Chem. Lett. 16, 13075 (2025). -
230
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). -
231
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). -
232
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). -
233
Compression-induced lattice tilting quenches ion migration at metal halide perovskite grain boundaries: A machine learning molecular dynamics study
M. R. Samatov, D. Liu, E. S. Amirov, M. A. Bubnova, A. E. Abrameshin, A. S. Kramarenko, P. A. Troshin, W. Chu, H. Zhou, O. V. Prezhdo, and A. S. Vasenko
J. Phys. Chem. Lett. 16, 13068 (2025). -
234
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). -
235
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). -
236
Optical addressability of the arylnitrene spin triplet
G. Ricci, C. Tonnele, and D. Casanova
J. Phys. Chem. Lett. 16, 5659 (2025). -
237
Polarizability, plasmons and damping in pseudospin-1 gapped materials
with a flat band
L. Zhemchuzhna, A. Iurov, G. Gumbs, and D. Huang
J. Phys.-Condes. Matter 37, 085701 (2025). -
238
Future of condensed matter physics for the next 10 years
J. Bird, J. Cheng, C. -G. Duan, T. Frederiksen, G. Kahl, G. Pacchioni, J. -G. Park, T. S. Rahman, S. R. Schofield, K. Sengupta, X. Xu, J. Zhao, and P. A. Dowben
J. Phys.-Condes. Matter 37, 421502 (2025). -
239
Intrinsic mechanical properties and seeding effect of tobermorite
synthesized in supercritical water
V. Musumeci, J. Li, E. Saeed, P. S. Camacho, K. Xu, P. J. M. Monteiro, J. S. Dolado, and C. Aymonier
J. Supercrit. Fluids 225, 106710 (2025). -
240
3DCryoHolder: a new open access 3D printable system to store and
transport silicon nitride membranes under cryogenic conditions for
spectromicroscopy at low temperature
A. Dominguez-Alfaro, and C. Sanchez-Cano
J. Synchrot. Radiat. 32, 225 (2025).