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7344 results: 7284 articles and 60 books or book chapters
Last updated: Sep 10, 2026-
2301
Knolker Iron Catalysts for Hydrogenation Revisited: A Nonspectator
Solvent and Fine-Tuning
M. Gimferrer, N. Joly, S. Escayola, E. Vinas, S. Gaillard, M. Sola, J. -L. Renaud, P. Salvador, and A. Poater
Organometallics 41, 1204 (2022). -
2302
Photoactive Platinum(II) Azopyridine Complexes(dagger)
S. J. Farley, L. Salassa, A. M. Pizarro, and P. J. Sadler
Photochem. Photobiol. 98, 92 (2022). -
2303
Excited state dynamics and conjugation effects of the photoisomerization
reactions of dihydroazulene
A. E. Hillers-Bendtsen, F. O. Kjeldal, N. Ree, E. Matito, and K. V. Mikkelsen
Phys. Chem. Chem. Phys. 24, 28934 (2022). -
2304
Giorgio Benedek: an extraordinary scientist and cultured gentleman
M. Bernasconi, R. Diez Muino, P. M. Echenique, J. R. Manson, S. Miret-Artes, and J. P. Toennies
Phys. Chem. Chem. Phys. 24, 28105 (2022). -
2305
Generation of multiple triplet states in an orthogonal bodipy dimer: a
breakthrough spectroscopic and theoretical approach
I. Garcia-Moreno, V. Postils, E. Rebollar, M. J. Ortiz, A. R. Agarrabeitia, and D. Casanova
Phys. Chem. Chem. Phys. 24, 5929 (2022). -
2306
Clarifying notes on the bonding analysis adopted by the energy
decomposition analysis
F. M. Bickelhaupt, C. F. Guerra, M. Mitoraj, F. Sagan, A. Michalak, S. Pan, and G. Frenking
Phys. Chem. Chem. Phys. 24, 15726 (2022). -
2307
Impact of the energy dispersion anisotropy on the plasmonic structure in
a two-dimensional electron system
U. Muniain, and V. M. Silkin
Phys. Chem. Chem. Phys. 24, 17885 (2022). -
2308
New trends and challenges in surface phenomena, carbon nanostructures
and helium droplets - Festschrift for Giorgio Benedek
M. Bernasconi, R. D. Muino, P. M. Echenique, J. R. Manson, S. Miret-Artes, and J. P. Toennies
Phys. Chem. Chem. Phys. 24, 28103 (2022). -
2309
Flavin-mediated photoactivation of Pt(iv) anticancer complexes:
computational insights on the catalytic mechanism
S. Scoditti, E. Dabbish, G. E. Pieslinger, E. Rezabal, X. Lopez, E. Sicilia, and L. Salassa
Phys. Chem. Chem. Phys. 24, 5323 (2022). -
2310
Three-centre electron sharing indices (3c-ESIs) as a tool to
differentiate among (an)agostic interactions and hydrogen bonds in
transition metal complexes
Y. Garcia-Rodeja Navarro, F. Feixas, E. Matito, and M. Sola
Phys. Chem. Chem. Phys. 24, 29333 (2022). -
2311
How to capture C2O2: structures and bonding of neutral and charged
complexes [(NHC)-C2O2-(NHC)](q) (NHC = N-heterocyclic carbene; q=0,
1+, 2+)
C. Ding, L. Yao, L. Zhao, and G. Frenking
Phys. Chem. Chem. Phys. 24, 16732 (2022). -
2312
Variation of bending rigidity with material density: bilayer silica with
nanoscale holes
M. Tomterud, S. D. Eder, C. Buechner, M. Heyde, H. -J. Freund, J. R. Manson, and B. Holst
Phys. Chem. Chem. Phys. 24, 30 (2022). -
2313
Surface dynamics on submonolayer Pb/Cu(001) surfaces
S. D. Borisova, V. Eremeev, G. G. Rusina, and V. Chulkov
Phys. Chem. Chem. Phys. 24, 5164 (2022). -
2314
Time-dependent density functional theory calculations of electronic
friction in non-homogeneous media
N. E. Koval, D. Sanchez-Portal, A. G. Borisov, and R. Diez Muino
Phys. Chem. Chem. Phys. 24, 20239 (2022). -
2315
On surface chemical reactions of free-base and titanyl porphyrins with
r-TiO2(110): a unified picture
L. Schio, D. Forrer, M. Casarin, A. Goldoni, C. Rogero, A. Vittadini, and L. Floreano
Phys. Chem. Chem. Phys. 24, 12719 (2022). -
2316
Semi-empirical and linear-scaling DFT methods to characterize duplex DNA
and G-quadruplexes in the presence of interacting small molecules
I. Ortiz de Luzuriaga, S. Elleuchi, K. Jarraya, E. Artacho, X. Lopez, and A. Gil
Phys. Chem. Chem. Phys. 24, 11510 (2022). -
2317
The role of high-energy phonons in electron-phonon interaction at
conducting surfaces with helium-atom scattering
G. Benedek, J. R. Manson, and S. Miret-Artes
Phys. Chem. Chem. Phys. 24, 23135 (2022). -
2318
Atom-surface scattering in the classical multiphonon regime
J. R. Manson, and S. Miret-Artes
Phys. Chem. Chem. Phys. 24, 16942 (2022). -
2319
Electron-phonon coupling and superconductivity in a 2D Tl-Pb compound on
Si(111)
I. Y. Sklyadneva, R. Heid, P. M. Echenique, and V. Chulkov
Phys. Chem. Chem. Phys. 24, 10140 (2022). -
2320
Unravelling the binding affinity and selectivity of molybdenum(ii)
phenanthroline complexes with DNA G-quadruplexes by using linear-scaling
DFT studies. The important role of ancillary ligands
I. O. de Luzuriaga, A. Sanchez-Gonzalez, W. Synoradzki, X. Lopez, and A. Gil
Phys. Chem. Chem. Phys. 24, 25918 (2022).