Search publications

Search results

7416 results: 7356 articles and 60 books or book chapters

1. 2381 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).
2. 2382 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).
3. 2383 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).
4. 2384 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).
5. 2385 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).
6. 2386 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).
7. 2387 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).
8. 2388 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).
9. 2389 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).
10. 2390 Atom-surface scattering in the classical multiphonon regime
    J. R. Manson, and S. Miret-Artes
    Phys. Chem. Chem. Phys. 24, 16942 (2022).
11. 2391 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).
12. 2392 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).
13. 2393 gamma gamma decay as a probe of neutrinoless beta beta decay nuclear matrix elements
    B. Romeo, J. Menendez, and C. Pena Garay
    Phys. Lett. B 827, 136965 (2022).
14. 2394 Dynamical stabilization by vacuum fluctuations in a cavity: Resonant electron scattering in the ultrastrong light-matter coupling regime
    D. A. Zezyulin, S. A. Kolodny, O. V. Kibis, I. Tokatly, and I. V. Iorsh
    Phys. Rev. A 106, 043708 (2022).
15. 2395 Dark solitons in a trapped gas of long-range interacting bosons
    M. Beau, A. del Campo, D. J. Frantzeskakis, T. P. Horikis, and P. G. Kevrekidis
    Phys. Rev. A 105, 023323 (2022).
16. 2396 Entropy-based formulation of thermodynamics in arbitrary quantum evolution
    S. Alipour, A. T. Rezakhani, A. Chenu, A. del Campo, and T. Ala-Nissila
    Phys. Rev. A 105, L040201 (2022).
17. 2397 Hybrid Photonic-Plasmonic Cavity Design for Very Large Purcell Factors at Telecommunication Wavelengths
    A. Barreda, L. Mercade, M. Zapata-Herrera, J. Aizpurua, and A. Martinez
    Phys. Rev. Appl. 18, 044066 (2022).
18. 2398 Tunable Near-Field Radiative Effect in a T-d-WTe2 Single Layer
    C. -L. Zhou, Z. Torbatian, X. -H. Wu, Y. Zhang, H. -L. Yi, and D. Novko
    Phys. Rev. Appl. 17, 014044 (2022).
19. 2399 Helicity Conservation for Mie Optical Cavities
    J. Olmos-Trigo, and X. Zambrana-Puyalto
    Phys. Rev. Appl. 18, 044007 (2022).
20. 2400 Room-Temperature van der Waals Perpendicular Ferromagnet Through Interlayer Magnetic Coupling
    Y. Cao, X. Zhang, X. -P. Zhang, F. Yan, Z. Wang, W. Zhu, H. Tan, V. N. Golovach, H. Zheng, and K. Wang
    Phys. Rev. Appl. 17, L051001 (2022).