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462 results: 462 articles and 0 books or book chapters

1. 161 Assessing the global natural orbital functional approximation on model systems with strong correlation
   I. Mitxelena, and M. Piris
   J. Chem. Phys. 160, 204106 (2024).
2. 162 Intramolecular singlet fission: quantum dynamical simulations including the effect of the laser field
   S. R. Reddy, P. B. Coto, and M. Thoss
   J. Chem. Phys. 160, 194306 (2024).
3. 163 Alternative CNDOL Fockians for fast and accurate description of molecular exciton properties
   L. A. Montero-Cabrera, A. L. Montero-Alejo, A. Aspuru-Guzik, J. M. G. de la Vega, M. Piris, L. A. Diaz-Fernandez, Y. Perez-Badell, A. Guerra-Barroso, J. E. Alfonso-Ramos, J. Rodriguez, M. E. Fuentes, and C. M. de Armas
   J. Chem. Phys. 160, 214108 (2024).
4. 164 Time evolution of natural orbitals in ab initio molecular dynamics
   A. Rivero Santamaria, and M. Piris
   J. Chem. Phys. 160, 071102 (2024).
5. 165 Electronic couplings for triplet-triplet annihilation upconversion in cystal rubrene
   A. Diaz-Andres, C. Tonnele, and D. Casanova
   J. Chem. Theory Comput. 20, 4288 (2024).
6. 166 Physically motivated improvements of variational quantum eigensolvers
   N. Vaquero-Sabater, A. Carreras, R. Orus, N. J. Mayhall, and D. Casanova
   J. Chem. Theory Comput. 20, 5133 (2024).
7. 167 Small-occupation density functional correlation energy correction to wave function approximations
   J. A. Rodriguez-Jimenez, A. Carreras, and D. Casanova
   J. Chem. Theory Comput. 20, 1118 (2024).
8. 168 Spurious oscillations caused by density functional approximations: Who is to blame? Exchange or correlation?
   S. P. Sitkiewicz, R. R. Ferradas, E. Ramos-Cordoba, R. Zalesny, E. Matito, and J. M. Luis
   J. Chem. Theory Comput. 20, 3144 (2024).
9. 169 Excited states by coupling Piris natural orbital functionals with the extended random-phase approximation
   J. F. H. Lew-Yee, I. A. Bonfil-Rivera, M. Piris, and J. M. del Campo
   J. Chem. Theory Comput. 20, 2140 (2024).
10. 170 Adaptive multi-stage integration schemes for Hamiltonian Monte Carlo
    L. Nagar, M. Fernandez-Pendas, J. M. Sanz-Serna, and E. Akhmatskaya
    J. Comput. Phys. 502, 112800 (2024).
11. 171 Growth history and quasar bias evolution at z < 3 from Quaia
    G. Piccirilli, G. Fabbian, D. Alonso, K. Storey-Fisher, J. Carron, A. Lewis, and C. Garcia-Garcia
    J. Cosmol. Astropart. Phys. 2024, 012 (2024).
12. 172 The effective field theory of large-scale structure and multi-tracer II:redshift space and realistic tracers
    T. Mergulhao, H. Rubirab, and R. Voivodicc
    J. Cosmol. Astropart. Phys. 2024, 008 (2024).
13. 173 Cosmic shear with small scales: DES-Y3, KiDS-1000 and HSC-DR1
    C. Garcia-Garcia, M. Zennaro, G. Arico, D. Alonso, and R. E. Angulo
    J. Cosmol. Astropart. Phys. 8, 24 (2024).
14. 174 Galaxy bias in the era of LSST: perturbative bias expansions
    A. Nicola, B. Hadzhiyska, N. Findlay, C. Garcia-Garcia, D. Alonso, A. Slosar, Z. Guo, N. Kokron, R. Angulo, A. Aviles, J. Blazek, J. Dunkley, B. Jain, M. Pellejero, J. Sullivan, C. W. Walter, and M. Zennaro
    J. Cosmol. Astropart. Phys. 2024, 15 (2024).
15. 175 Study of paraffinic and biobased microencapsulated PCMs with reduced graphene oxide as thermal energy storage elements in cement-based materials for building applications
    E. Erkizia, C. Strunz, J. -l. Dauvergne, G. Goracci, I. Peralta, A. Serrano, A. Ortega, B. Alonso, F. Zanoni, M. Duengfelder, J. S. Dolado, J. J. Gaitero, C. Mankel, and E. Koenders
    J. Energy Storage 84, 110675 (2024).
16. 176 Exploring the role of surface roughness in concrete-based thermal energy storage systems: A computational study
    M. Rahjoo, E. Rojas, G. Goracci, and J. S. Dolado
    J. Energy Storage 88, 111515 (2024).
17. 177 Luminescence of Nd3+-doped LaF3 glass-ceramics enhanced with Ag nanoparticles
    M. Sedano, G. Gorni, G. C. Mather, A. Duran, J. Fernandez, R. Balda, and M. J. Pascual
    J. Eur. Ceram. Soc. 44, 2427 (2024).
18. 178 Search for hidden neutrinos at the European Spallation Source: the SHiNESS experiment
    S. R. Soleti, P. Coloma, J. J. Gomez Cadenas, and A. Cabrera
    J. High Energy Phys. 2024, 148 (2024).
19. 179 A refreshing approach to understanding the action on DNA of vanadium (IV) and (V) complexes derived from the anticancer VCp2Cl2
    L. Soriano-Agueda, and A. Guevara-Garcia
    J. Inorg. Biochem. 261, 112705 (2024).
20. 180 Design, characterization and installation of the NEXT-100 cathode and electroluminescence regions
    K. Mistry, L. Rogers, B. J. P. Jones, B. Munson, L. Norman, D. Oliver, S. Pingulkar, M. Rodriguez-Tiscareno, K. Silva, K. Stogsdill, C. Adams, H. Almazan, V. Alvarez, B. Aparicio, A. I. Aranburu, L. Arazi, I. J. Arnquist, F. Auria-Luna, S. Ayet, C. D. R. Azevedo, et al.
    J. Instrum. 19, P02007 (2024).