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7199 results: 7139 articles and 60 books or book chapters

1. 461 Optical and excitonic properties of calcite CaCO3
   J. Janovec, J. S. Dolado, and A. Ayuela
   J. Mater. Chem. C 13, 6267 (2025).
2. 462 Exploring the structural relaxation in 2-ethyl-1-hexanol by neutron spin echo: from intermolecular and supramolecular correlations to long-range density fluctuations
   S. Arrese-Igor, J. Colmenero, J. Allgaier, M.D. Ruiz-Martín, B. Farago and, A. Arbe.
   J. Mol. Liq. 438, 128600 (2025).
3. 463 Thermodynamic model for the structure of Nd doped phosphate laser glasses and the neodymium chemistry influence on their emission properties
   A. Lopez-Grande, J. Azkargorta, I. Iparraguirre, G. Tricot, S. Garcia-Revilla, J. Fernandez, R. Balda, and F. Munoz
   J. Non-Cryst. Solids 668, 123779 (2025).
4. 464 WikiTextGraph: A python tool for parsing multilingual wikipedia text and graph extraction
   Paschalis Agapitos, Juan-Luis Suárez, and Gustavo Ariel Schwartz
   J. Open Res. Softw. 13, 17 (2025).
5. 465 Computational analysis of the Lewis acid-catalyzed zwitterionic ring-expansion polymerization (ZREP) of monosubstituted ethylene oxide
   X. Gastearena, F. Barroso-Bujans, F. Ruiperez, and J. M. Matxain
   J. Org. Chem. 90, 2592 (2025).
6. 466 Mechanistic insights into copper-catalyzed alkene aminofluorination and rational design of a metal-free strategy
   Y. Zhang, S. Zhang, J. Xu, S. Ge, S. Sun, G. Frenking, and L. Zhao
   J. Org. Chem. 90, 8601 (2025).
7. 467 Toward a systematics for the lowest excited states of heteroaromatics enabled via cyclic π-conjugated carbenes and heteroelement analogues
   N. P. Vedin, J. M. Toldo, S. Escayola, S. Radenkovic, M. Sola, and H. Ottosson
   J. Org. Chem. 90, 9743 (2025).
8. 468 Ru-Sn and Ru-Os mixed-metal clusters bearing heterocyclic thiolate ligand(s): Synthesis, crystal and electronic structures
   M. M. Hossain, V. N. Nesterov, G. Hogarth, G. E. Pieslinger, S. E. Kabir, and S. Ghosh
   J. Organomet. Chem. 1031, 123593 (2025).
9. 469 Origins of the anomalous Hall conductivity in the symmetry enforced Fe3GeTe2 nodal-line ferromagnet
   M. Garcia-Diez, H. Beidenkopf, I. Robredo, and M. G. Vergniory
   J. Phys-Mater. 8, 035012 (2025).
10. 470 Artificial intelligence for advanced functional materials: exploring current and future directions
    C. Malica, K. S. Novoselov, A. S. Barnard, V. Kalinin, S. R. Spurgeon, K. Reuter, M. Alducin, V. L. Deringer, G. Csanyi, N. Marzari, S. Huang, G. Cuniberti, Q. Deng, P. Ordejon, I. Cole, K. Choudhary, K. Hippalgaonkar, R. Zhu, O. A. von Lilienfeld, M. Hibat-Allah, et al.
    J. Phys-Mater. 8, 021001 (2025).
11. 471 Oligothiophene-based photovoltaic materials for organic solar cells: Exciton properties by the CNDOL Fockian approach
    A. Guerra-Barroso, Y. Perez-Badell, A. L. Montero-Alejo, and L. A. Montero-Cabrera
    J. Phys. Chem. A 129, 3202 (2025).
12. 472 Assessing second-order perturbative corrections to restricted active space CI for valence excitations in organic molecules
    J. B. Perumal Marisami, and D. Casanova
    J. Phys. Chem. A 129, 11736 (2025).
13. 473 A-H•••π Hydrogen bonds - Where are proton acceptor sites located?
    S. J. Grabowski
    J. Phys. Chem. A 129, 11650 (2025).
14. 474 The electron−phonon interaction at the (110) surface of hydrogen covered Mo1−xRex alloys from helium atom scattering
    Giorgio Benedek, Björn Flach, Joseph R. Manson, Salvador Miret-Artés, and J. Peter Toennies
    J. Phys. Chem. C 129, 17632 (2025).
15. 475 Second harmonic response of azobenzene self-assembled monolayers: the effect of push/pull substitution
    A. Dellai, L. Muccioli, F. Castet, and C. Tonnele
    J. Phys. Chem. C 129, 8417 (2025).
16. 476 Semianalytical treatment of collective vibrational strong coupling in infrared phononic and plasmonic nanoantennas
    J. Sepulveda, J. L. Montano-Priede, J. Aizpurua, and R. Esteban
    J. Phys. Chem. C 129, 12374 (2025).
17. 477 Hydrogen disproportionation reduces the bandgap and prolongs the carrier lifetime in Cs2AgBiBr6: Quantum dynamics analysis
    E. S. Amirov, D. Liu, M. R. Samatov, D. A. Abrameshin, A. E. Abrameshin, A. S. Kramarenko, P. A. Troshin, W. Chu, H. Zhou, A. S. Vasenko, and O. V. Prezhdo
    J. Phys. Chem. Lett. 16, 13075 (2025).
18. 478 Exciton properties and broadband emission in two-dimensional Ruddlesden-Popper perovskites
    J. Tan, X. Jiang, D. Liu, Z. -K. Tang, E. V. Chulkov, and A. S. Vasenko
    J. Phys. Chem. Lett. 16, 7659 (2025).
19. 479 Anharmonic motion-induced self-passivation of hydrogen defects in hybrid organic-inorganic perovskites: Ab initio quantum dynamics
    X. Tian, A. S. Vasenko, E. V. Chulkov, and R. Long
    J. Phys. Chem. Lett. 16, 10466 (2025).
20. 480 Molecular derailment via pressurization in methylammonium lead iodide
    P. Marin-Villa, P. Gila-Herranz, M. Jimenez-Ruiz, A. Ivanov, J. Armstrong, K. Druzbicki, and F. Fernandez-Alonso
    J. Phys. Chem. Lett. 16, 10906 (2025).