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Last updated: 11/04/2024-
241 Ferroelectric polarization and single-atom catalyst synergistically promoting CO2 photoreduction of CuBiP2Se6
X. Jiang, J. Tan, D. Liu, Y. Feng, K. -Q. Chen, E. A. Kazakova, A. S. Vasenko, and E. V. Chulkov
J. Phys. Chem. Lett. 15, 3611 (2024). -
242 Length scale of molecular motions governing glass equilibration in hyperquenched and slow-cooled polystyrene
J. Luo, X. Wang, B. Tong, Z. Li, L. A. Rocchi, V. Di Lisio, D. Cangialosi, and B. Zuo
J. Phys. Chem. Lett. 15, 357 (2024). -
243 Ab initio study of the influence of spin and orbital magnetic moments on the stability of magnetic and charge distribution in Co:ZnO monolayer
A. V. Prokhorenko, A. N. Chibisov, A. A. Gnidenko, M. A. Chibisova, K. V. Obrazcov, A. S. Vasenko, and A. Srivastava
J. Phys. Chem. Lett. 15, 10295 (2024). -
244 Enhanced charge separation in single atom cobalt based graphitic carbon nitride: time domain Ab Initio analysis
S. Agrawal, D. Casanova, D. J. Trivedi, and O. V. Prezhdo
J. Phys. Chem. Lett. 15, 2202 (2024). -
245 Origin of the improved photoelectrochemical and photocatalytic activity in a ZnO-TiO2 nanohybrid revealed by experimental and density functional theory studies
A. Das, D. Liu, Y. Wu, B. A. Abzakh, R. Madhumitha, M. Preethi, E. A. Kazakova, A. S. Vasenko, and O. V. Prezhdo
J. Phys. Chem. Lett. 15, 7524 (2024). -
246 Three-dimensional photonic crystals based on porous anodic aluminum oxide
I. V. Roslyakov, S. E. Kushnir, V. B. Novikov, A. A. Dotsenko, D. M. Tsymbarenko, N. A. Sapoletova, T. V. Murzina, V. S. Stolyarov, and K. S. Napolskii
J. Phys. Chem. Lett. 15, 4319 (2024). -
247 Stained glass effect in anodic aluminum oxide formed in selenic acid
S. E. Kushnir, N. P. Devyanina, I. V. Roslyakov, N. V. Lyskov, V. S. Stolyarov, and K. S. Napolskii
J. Phys. Chem. Lett. 15, 298 (2024). -
248 Plasmon excitations across the charge-density-wave transition in single-layer TiSe2
Z. Torbatian, and D. Novko
J. Phys. Chem. Lett. 15, 6045 (2024). -
249 Improved carrier separation and recombination by ferroelectric polarization in the CuBiP2Se6/C2N heterostructure: a nonadiabatic molecular dynamics study
X. Jiang, J. Tan, D. Liu, Y. Feng, K. -Q. Chen, R. Long, and A. S. Vasenko
J. Phys. Chem. Lett. 15, 2867 (2024). -
250 Spin mixing in intramolecular singlet fission: a first-principles-based quantum dynamical study
R. K. Kathir, P. B. Coto, and M. Thoss
J. Phys. Chem. Lett. 15, 11517 (2024). -
251 Predictive guidelines for electrocyclization of dithienylethenes
C. Climent, Z. Xu, M. O. Wolf, and D. Casanova
J. Phys. Chem. Lett. 15, 8042 (2024). -
252 Ion migration at metal halide perovskite grain boundaries elucidated with a machine learning force field
M. R. Samatov, D. Liu, L. Zhao, E. A. Kazakova, D. A. Abrameshin, A. Das, A. S. Vasenko, and O. V. Prezhdo
J. Phys. Chem. Lett. 15, 12362 (2024). -
253 Identifying rare events in quantum molecular dynamics of nanomaterials with outlier detection indices
B. Wang, D. Liu, Y. Wu, A. S. Vasenko, and O. V. Prezhdo
J. Phys. Chem. Lett. 15, 10384 (2024). -
254 Quantifying shape transition in anisotropic plasmonic nanoparticles through geometric inversion. Application to gold bipyramids
J. L. Montano-Priede, A. Sanchez-Iglesias, S. A. Mezzasalma, J. Sancho-Parramon, and M. Grzelczak
J. Phys. Chem. Lett. 15, 3914 (2024). -
255 The emergence of the hexagonal lattice in two-dimensional Wigner fragments
M. E. Azor, A. Alrakik, L. de Bentzmann, X. Telleria-Allika, A. S. de Meras, S. Evangelisti, and J. A. Berger
J. Phys. Chem. Lett. 15, 3571 (2024). -
256 Formation and recombination dynamics of polarons in goethite: a time-domain ab initio study
H. Li, Z. Zhou, A. S. Vasenko, E. V. Chulkov, Q. Fang, and R. Long
J. Phys. Chem. Lett. 15, 10018 (2024). -
257 Adsorption of As nano-clusters on different graphene environments
R. H. Aguilera-del-Toro, A. Garcia-Garcia, A. Moreno-Barcenas, and F. Aguilera-Granja
J. Phys. Chem. Solids 196, 112383 (2024). -
258 Nanocomposite materials as observed by mass-selective neutron spectroscopy
M. Krzystyniak, G. Romanelli, B. Grabowska, and F. Fernandez-Alonso
J. Phys. Commun. 8, 022001 (2024). -
259 Optical properties and plasmons in moiré structures
X. Kuang, P. A. Pantaleon Peralta, J. Angel Silva-Guillen, S. Yuan, F. Guinea, and Z. Zhan
J. Phys.-Condes. Matter 36, 173001 (2024). -
260 Anisotropic optical conductivities of model topological nodal-line semimetals
S. Kandel, G. Gumbs, and O. L. Berman
J. Phys.-Condes. Matter 36, 025301 (2024).