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7139 results: 7096 articles and 43 books or book chapters

1. 2101 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).
2. 2102 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).
3. 2103 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).
4. 2104 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).
5. 2105 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).
6. 2106 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).
7. 2107 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).
8. 2108 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).
9. 2109 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).
10. 2110 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).
11. 2111 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).
12. 2112 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).
13. 2113 Atom-surface scattering in the classical multiphonon regime
    J. R. Manson, and S. Miret-Artes
    Phys. Chem. Chem. Phys. 24, 16942 (2022).
14. 2114 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).
15. 2115 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).
16. 2116 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).
17. 2117 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).
18. 2118 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).
19. 2119 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).
20. 2120 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).