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7406 results: 7346 articles and 60 books or book chapters

1. 1721 Multimerizations, aggregation, and transfer reactions of small numbers of molecules
   R. Zangi
   J. Chem Inf. Model. 63, 4383 (2023).
2. 1722 Molecular Berry curvatures and the adiabatic response tensors
   R. Resta
   J. Chem. Phys. 158, 024105 (2023).
3. 1723 Non-simple flow behavior in a polar van der Waals liquid: Structural relaxation under scrutiny
   S. Arrese-Igor, A. Alegria, and J. Colmenero
   J. Chem. Phys. 158, 174504 (2023).
4. 1724 The Debye's model for the dielectric relaxation of liquid water and the role of cross-dipolar correlations. A MD-simulations study
   F. Alvarez, A. Arbe, and J. Colmenero
   J. Chem. Phys. 159, 134505 (2023).
5. 1725 Outstanding improvement in removing the delocalization error by global natural orbital functional
   J. F. H. Lew-Yee, M. Piris, and J. M. del Campo
   J. Chem. Phys. 158, 084110 (2023).
6. 1726 Physical aging in molecular glasses beyond the α relaxation
   V. Di Lisio, V. -M. Stavropoulou, and D. Cangialosi
   J. Chem. Phys. 159, 064505 (2023).
7. 1727 Orbital-free density-functional theory for metal slabs
   C. M. Horowitz, C. R. Proetto, and J. M. Pitarke
   J. Chem. Phys. 159, 164112 (2023).
8. 1728 What can lattice DFT teach us about real-space DFT?
   N. Sobrino, D. Jacob, and S. Kurth
   J. Chem. Phys. 159, 154110 (2023).
9. 1729 Collective dynamics and self-motions in the van der Waals liquid tetrahydrofuran from meso- to inter-molecular scales disentangled by neutron spectroscopy with polarization analysis
   A. Arbe, G. J. Nilsen, M. Devonport, B. Farago, F. Alvarez, J. A. M. Gonzalez, and J. Colmenero
   J. Chem. Phys. 158, 184502 (2023).
10. 1730 Electron correlation in the Iron(II) porphyrin by natural orbital functional approximations
    J. F. H. Lew-Yee, J. M. del Campo, and M. Piris
    J. Chem. Theory Comput. 19, 211 (2023).
11. 1731 All-purpose measure of electron correlation for multireference diagnostics
    X. Xu, L. Soriano-Agueda, X. Lopez, E. Ramos-Cordoba, and E. Matito
    J. Chem. Theory Comput. 20, 721 (2023).
12. 1732 Are accelerated and enhanced wave function methods accurate to compute static linear and nonlinear optical properties?
    C. Naim, P. Besalu-Sala, R. Zalesny, J. M. Luis, F. Castet, and E. Matito
    J. Chem. Theory Comput. 19, 1753 (2023).
13. 1733 Extracting quantitative information at quantum mechanical level from noncovalent interaction index analyses
    E. K. Wieduwil, R. A. Boto, G. Macetti, R. Laplaza, J. Contreras-Garcia, and A. Genoni
    J. Chem. Theory Comput. 19, 1063 (2023).
14. 1734 Electronic descriptors for supervised spectroscopic predictions
    C. M. de Armas-Morejon, L. A. Montero-Cabrera, A. Rubio, and J. Jornet-Somoza
    J. Chem. Theory Comput. 19, 1818 (2023).
15. 1735 Insights into the coordination chemistry of antineoplastic doxorubicinwith 3d-transition metal ions Zn2+, Cu2+, and VO2+: a study using well-calibrated thermodynamic cyclesand chemical interaction quantum chemistry models
    J. Reyna-Luna, L. Soriano-Agueda, C. J. Vera, and M. Franco-Perez
    J. Comput.-Aided Mol. Des. 37, 279 (2023).
16. 1736 Euclid: modelling massive neutrinos in cosmology a codecomparison
    J. Adamek, R. E. Angulo, C. Arnold, M. Baldi, M. Biagetti, B. Bose, C. Carbone, T. Castro, J. Dakin, K. Dolag, W. Elbers, C. Fidler, C. Giocoli, S. Hannestad, F. Hassani, C. Hernandez-Aguayo, K. Koyama, B. Li, R. Mauland, P. Monaco, et al.
    J. Cosmol. Astropart. Phys. 06, 035 (2023).
17. 1737 Dark matter from primordial black holes would hold charge
    I. J. Araya, N. D. Padilla, M. E. Rubio, J. Sureda, J. Magana, and L. Osorio
    J. Cosmol. Astropart. Phys. 02, 030 (2023).
18. 1738 A numerical study of geopolymer concrete thermal energy storage: Benchmarking TES module design and optimizing thermal performance
    M. Rahjoo, E. Rojas, G. Goracci, J. J. Gaitero, P. Martauz, and J. S. Dolado
    J. Energy Storage 74, 109389 (2023).
19. 1739 Demonstration of neutrinoless double beta decay searches in gaseous xenon with NEXT
    P. Novella, M. Sorel, A. Uson, C. Adams, H. Almazan, V. Alvarez, B. Aparicio, I. Aranburu, L. Arazi, I. J. Arnquist, F. Auria-Luna, S. Ayet, C. D. R. Azevedo, K. Bailey, F. Ballester, M. del Barrio-Torregrosa, A. Bayo, J. M. Benlloch-Rodriguez, F. I. G. M. Borges, S. Bounasser, et al.
    J. High Energy Phys. 2023, 190 (2023).
20. 1740 Non-Hermitian Hamiltonian deformations in quantum mechanics
    A. S. Matsoukas-Roubeas, F. Roccati, J. Cornelius, Z. Xu, A. Chenu, and A. del Campo
    J. High Energy Phys. 2023, 60 (2023).