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7397 results: 7337 articles and 60 books or book chapters

1. 141 Elucidating the mechanism of photoinduced sulfur monoxide extrusion from dianthryl sulfoxide
   H. Noguchi, C. Climent, K. -M. Tong, J. Yuan, C. J. Walsby, D. Casanova, and M. O. Wolf
   J. Am. Chem. Soc. 148, 34678 (2026).
2. 142 Band gap renormalization drives ultrafast charge separation and slow recombination in covalently functionalized carbon nanotubes: Nonadiabatic molecular dynamics simulation
   U. Chowdhury, S. Mondal, S. Dey, A. R. Das, R. Sarkar, M. Chaudhary, A. S. Vasenko, O. V. Prezhdo, and S. Pal
   J. Am. Chem. Soc. 148, 24538 (2026).
3. 143 Direct experimental evidence of transient Auδ+ oxide in Au electrooxidation
   J. Redondo, A. Etxebarria, P. K. Samal, L. Albons, R. F. Climent, S. Auras, B. Smid, X. Ju, P. Matvija, F. Schiller, M. Setvin, J. Myslivecek, and S. Barja
   J. Am. Chem. Soc. 148, 12587 (2026).
4. 144 Open- and closed-shell roles of sensitizer and annihilato in pseudo-single component mixtures for ppconversion
   K. D. Richards, W. Wang, P. Thielert, J. D. Green, J. M. Hudson, C. Tonnele, D. Casanova, Y. Olivier, T. J. H. Hele, S. Richert, F. Li, and E. W. Evans
   J. Am. Chem. Soc. 148, 35375 (2026).
5. 145 Emergent heavy-fermion physics in a family of topological insulators RAsS (R = Y, La, and Sm)
   I. Robredo, Y. Fang, L. Chen, N. Zaremba, Y. Prots, M. Krnel, M. Konig, M. I. Iraola, T. Doert, J. van den Brink, C. Felser, Q. Si, E. Svanidze, and M. G. Vergniory
   J. Am. Chem. Soc. 148, 12979 (2026).
6. 146 Suppressing anisotropy in nanostructured Fe/Ni superlattices with monolayer periodicity
   I. Llamas, S. Aberturas, J. L. Fernandez-Cunado, C. Navio, A. Hernando, and R. Miranda
   J. Appl. Phys. 140, 053901 (2026).
7. 147 Proactive resource management for low-carbon cement: Application of low-grade clays in limestone calcined clay cement (LC3)
   Z. Zhang, Y. Chen, L. Cai, W. Cao, Z. Lv, M. Ye, Q. Yu, and S. Yin
   J. Build. Eng. 121, 115604 (2026).
8. 148 Computational Analysis of ELOVL6 Structure and Inhibition for RationalDrug Design
   M. G. Ibarluzea, R. Ramis, M. Fuentetaja, F. J. Gil-Bea, G. Gerenu, A. Lopez De Munain, J. M. Aizpurua, J. I. Miranda, A. Bergara, and A. Leonardo
   J. Chem Inf. Model. 66, 7264 (2026).
9. 149 MartiniSurf: Automated simulations of surface-immobilized biomolecular systems with Martini
   J. C. Jimenez-Garcia, F. Lopez-Gallego, X. Lopez, and D. De Sancho
   J. Chem Inf. Model. 66, 8683 (2026).
10. 150 A Python-based module for exploring machine learning-inspired optimization algorithms using quantum chemistry
    J. F. H. Lew-Yee, E. Rezabal, X. Lopez, M. Piris, and J. M. Mercero
    J. Chem. Educ. 103, 3929 (2026).
11. 151 Differential equilibration in cis- and trans-ceramide monolayers: A molecular dynamics study
    L. Saiz, J. M. G. Vilar, F. M. Goni, and A. Alonso
    J. Chem. Phys. 164, 185102 (2026).
12. 152 Molecular contributions to the thermal neutron cross sections of O2, N2, and air
    M. Simoni, F. Fernandez-Alonso, T. Giovannini, M. Krzystyniak, J. I. M. Damian, A. Marsicano, M. Martellucci, T. Minniti, R. Senesi, M. Sorbara, and G. Romanelli
    J. Chem. Phys. 164, 134109 (2026).
13. 153 Interplay between electronic and phononic energy dissipation channels in the adsorption of CO on Cu(110)
    C. A. Tachino, F. J. Gonzalez, A. S. Muzas, J. I. Juaristi, M. Alducin, and H. F. Busnengo
    J. Chem. Phys. 164, 224703 (2026).
14. 154 On the application of single parameteraging to glass equilibration
    V. Di Lisio, and D. Cangialosi
    J. Chem. Phys. 165, 134505 (2026).
15. 155 Mesoscale dynamics and the microscopic origin of the Q0-mode in molecular liquids: A molecular dynamics study of tetrahydrofuran
    D. Ghoshal, F. Alvarez, A. Arbe, and J. Colmenero
    J. Chem. Phys. 165, 054501 (2026).
16. 156 Toward more accurate natural orbital functional approximations: Including 4-index cumulant contributions
    V. Chuiko, P. W. Ayers, and E. Matito
    J. Chem. Phys. 165, 054105 (2026).
17. 157 Quantum dynamical and isotopic effects for hydrogen isotope scattering at W(110) surface
    R. Bombin, O. Galparsoro, D. Pelaez, J. C. Tremblay, C. Crespos, and P. Larregaray
    J. Chem. Phys. 165, 064702 (2026).
18. 158 Machine learned potential for defected single layer hexagonal boron nitride
    J. Janisch, D. Le, and T. S. Rahman
    J. Chem. Phys. 164, 154705 (2026).
19. 159 Mixed quantum-classical simulations of intramolecular singlet fission
    R. Smorka, J. E. Runeson, M. Thoss, S. R. Reddy, P. B. Coto, J. R. Mannouch, and J. O. Richardson
    J. Chem. Phys. 165, 034302 (2026).
20. 160 DoNOF 2.0: A modern open-source electronic structure program for natural orbital functionals
    J. F. H. Lew-Yee, I. Mitxelena, J. M. del Campo, and M. Piris
    J. Chem. Phys. 164, 072501 (2026).