Search publications

Search results

6316 results: 6276 articles and 40 books or book chapters

1. 81 Thermal conductivity of Portlandite: molecular dynamics based approach
   P. K. Sarkar, G. Goracci, and J. S. Dolado
   Cem. Concr. Res. 175, 107347 (2024).
2. 82 Thermoelectric properties of the main species present in Portland cement
   R. O. Agbaoye, J. Janovec, A. Ayuela, and J. S. Dolado
   Cem. Concr. Res. 183, 107587 (2024).
3. 83 Colour tuning in Eu/Ag-co-doped transparent LaF3 glass-ceramics
   M. Sedano, A. Duran, G. C. Mather, J. Fernandez, R. Balda, and M. J. Pascual
   Ceram. Int. 50, 23839 (2024).
4. 84 Hydrogen bond types which do not fit accepted definitions
   S. J. Grabowski
   Chem. Commun. 60, 6239 (2024).
5. 85 Promoting exchange coupling in (CpiPr5)2Gd2X3 complexes
   G. David, B. Le Guennic, and D. Reta
   Chem. Commun. 60, 11988 (2024).
6. 86 Can aromaticity be evaluated using atomic partitions based on the Hilbert-space?
   J. Grèbol-Tomàs, E. Matito, and P. Salvador
   Chem. Eur. J. 30, e202401282 (2024).
7. 87 Revisiting El-Sayed synthesis: Bayesian optimization for revealing new insights during the growth of gold nanorods
   A. Rao, and M. Grzelczak
   Chem. Mat. 36, 2577 (2024).
8. 88 Compression eliminates charge traps by stabilizing perovskite grain boundary structures: an ab initio analysis with machine learning force field
   D. Liu, Y. Wu, M. R. Samatov, A. S. Vasenko, E. V. Chulkov, and O. V. Prezhdo
   Chem. Mat. 36, 2898 (2024).
9. 89 A hydration model of actinide complexes by exploring their multipleminima hypersurface: the case of uranyl cation
   A. Guerra-Barroso, Y. Perez-Badell, A. L. Montero-Alejo, M. E. Montero-Cabrera, and L. A. Montero-Cabrera
   Chem. Phys. Lett. 856, 141667 (2024).
10. 90 Perylene-derivative singlet exciton fission in water solution
    C. Magne, S. Streckaite, R. A. Boto, E. Dominguez-Ojeda, M. Gromova, A. Echeverri, F. S. Brigiano, M. -H. Ha-Thi, M. Fanckevicius, V. Jasinskas, A. Quaranta, A. A. Pascal, M. Koepf, D. Casanova, T. Pino, B. Robert, J. Contreras-Garcia, D. Finkelstein-Shapiro, V. Gulbinas, and M. J. Llansola-Portoles, et al.
    Chem. Sci. 15, 17831 (2024).
11. 91 Strong-field effects in the photo-induced dissociation of the hydrogen molecule on a silver nanoshell
    N. E. Koval, J. I. Juaristi, and M. Alducin
    Chem. Sci. , (2024).
12. 92 Exploring the potential of natural orbital functionals
    M. Piris
    Chem. Sci. 15, 17284 (2024).
13. 93 Core-electron contributions to the magnetic response of molecules withheavy elements and their significance in aromaticity assessments
    M. Orozco-Ic, L. Soriano-Agueda, D. Sundholm, E. Matito, and G. Merino
    Chem. Sci. 15, 12906 (2024).
14. 94 Deciphering the chemical bonding of the trivalent oxygen atom in oxygen doped graphene
    A. Ugartemendia, I. Casademont-Reig, L. Zhao, Z. Zhang, G. Frenking, J. M. Ugalde, A. Garcia-Lekue, and E. Jimenez-Izal
    Chem. Sci. 15, 6151 (2024).
15. 95 %VBur index and steric maps: from predictive catalysis to machine learning
    S. Escayola, N. Bahri-Laleh, and A. Poater
    Chem. Soc. Rev. 53, 853 (2024).
16. 96 3,4-Dimethylenecyclobutene: a building block for design of macrocycles with excited state aromatic low-lying high-spin states
    P. Preethalayam, J. C. Roldao, F. Castet, D. Casanova, S. Radenkovic, and H. Ottosson
    Chem.-Eur. J. 30, e202303549 (2024).
17. 97 Oxygen-promoted on-surface synthesis of polyboroxine molecules
    D. Toffoli, E. Turco, M. Stredansky, R. Costantini, M. Dell Angela, L. Floreano, A. Goldoni, A. Morgante, G. Kladnik, D. Cvetko, D. G. de Oteyza, L. Colazzo, M. S. G. Mohammed, A. Sala, G. Comelli, C. Africh, G. Fronzoni, G. Balducci, M. Stener, H. Ustunel, et al.
    Chem.-Eur. J. 30, e202401565 (2024).
18. 98 Temperature-modulated reversible clustering of gold nanorods driven by small surface ligands
    J. Kruse, A. Rao, A. Sanchez-Iglesias, J. L. Montano-Priede, A. I. Ibarra, E. Lopez, A. Seifert, A. Arbe, and M. Grzelczak
    Chem.-Eur. J. 30, e202302793 (2024).
19. 99 Gold-promoted biocompatible selenium arylation of small molecules, peptides and proteins
    D. H. Nakahata, I. Kanavos, M. Zubiria-Ulacia, A. Inague, L. Salassa, R. Lobinski, S. Miyamoto, J. M. Matxain, L. Ronga, and R. E. F. de Paiva
    Chem.-Eur. J. 30, e202304050 (2024).
20. 100 On-surface stepwise double dehydrogenation for the formation of a para-quinodimethane-containing undecacene isomer
    S. Sarkar, B. Alvarez, K. H. Au-Yeung, A. Cobas, R. Robles, N. Lorente, D. Pena, D. Perez, and F. Moresco
    Chem.-Eur. J. 30, e202402297 (2024).