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6848 results: 6810 articles and 38 books or book chapters

1. 1161 Single-not double-3D-aromaticity in an oxidized closo icosahedral dodecaiodo-dodecaborate cluster
   J. Poater, S. Escayola, A. Poater, F. Teixidor, H. Ottosson, C. Vinas, and M. Sola
   J. Am. Chem. Soc. 145, 22527 (2023).
2. 1162 V-Shaped troger oligothiophenes boost triplet formation by CT mediation and symmetry breaking
   S. M. Rivero, M. J. Alonso-Navarro, C. Tonnele, J. M. Marin-Beloqui, F. Suarez-Blas, T. M. Clarke, S. Kang, J. Oh, M. M. Ramos, D. Kim, D. Casanova, J. L. Segura, and J. Casado
   J. Am. Chem. Soc. 145, 27295 (2023).
3. 1163 Accurate and efficient spin-phonon coupling and spin dynamics calculations for molecular solids
   R. Nabi, J. K. Staab, A. Mattioni, J. G. C. Kragskow, D. Reta, J. M. Skelton, and N. F. Chilton
   J. Am. Chem. Soc. 145, 24558 (2023).
4. 1164 Molecular bridge engineering for tuning quantum electronic transport and anisotropy in nanoporous graphene
   C. Moreno, X. D. de Cerio, M. Vilas-Varela, M. Tenorio, A. Sarasola, M. Brandbyge, D. Pena, A. Garcia-Lekue, and A. Mugarza
   J. Am. Chem. Soc. 145, 8988 (2023).
5. 1165 Tuning the diradical character of pentacene derivatives via non-benzenoid coupling motifs
   T. Wang, P. Angulo-Portugal, A. Berdonces-Layunta, A. Jancarik, A. Gourdon, J. Holec, M. Kumar, D. Soler, P. Jelinek, D. Casanova, M. Corso, D. G. de Oteyza, and J. P. Calupitan
   J. Am. Chem. Soc. 145, 10333 (2023).
6. 1166 Interplay between magnetism and topology: large topological Hall effect in an antiferromagnetic topological insulator, EuCuAs
   S. Roychowdhury, K. Samanta, P. Yanda, B. Malaman, M. Yao, W. Schnelle, E. Guilmeau, P. Constantinou, S. Chandra, H. Borrmann, M. G. G. Vergniory, V. Strocov, C. Shekhar, and C. Felser
   J. Am. Chem. Soc. 145, 12920 (2023).
7. 1167 Experimental observation of diffractive retroreflection from a dielectric metasurface
   A. S. Kupriianov, V. V. Khardikov, K. Domina, S. L. Prosvirnin, W. Han, and V. R. Tuz
   J. Appl. Phys. 133, 163101 (2023).
8. 1168 Molecular dynamics simulations of the calmodulin-induced α-helix in the SK2 calcium-gated potassium ion channel
   R. Ramis, O. R. Ballesteros, A. Muguruza-Montero, S. M-Alicante, E. Nunez, A. Villarroel, A. Leonardo, and A. Bergara
   J. Biol. Chem. 299, 102850 (2023).
9. 1169 Therapeutic effect of α7 nicotinic receptor activation after ischemic stroke in rats
   L. Aguado, A. Joya, M. Garbizu, S. Plaza-Garcia, L. Iglesias, M. I. Hernandez, M. Ardaya, N. Mocha, V. Gomez-Vallejo, U. Cossio, M. Higuchi, A. Rodriguez-Antiguedad, M. M. Freijo, M. Domercq, C. Matute, P. Ramos-Cabrer, J. Llop, and A. Martin
   J. Cereb. Blood Flow Metab. 43, 1301 (2023).
10. 1170 Multimerizations, aggregation, and transfer reactions of small numbers of molecules
    R. Zangi
    J. Chem Inf. Model. 63, 4383 (2023).
11. 1171 Molecular Berry curvatures and the adiabatic response tensors
    R. Resta
    J. Chem. Phys. 158, 024105 (2023).
12. 1172 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).
13. 1173 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).
14. 1174 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).
15. 1175 Physical aging in molecular glasses beyond the α relaxation
    V. Di Lisio, V. -M. Stavropoulou, and D. Cangialosi
    J. Chem. Phys. 159, 064505 (2023).
16. 1176 Orbital-free density-functional theory for metal slabs
    C. M. Horowitz, C. R. Proetto, and J. M. Pitarke
    J. Chem. Phys. 159, 164112 (2023).
17. 1177 What can lattice DFT teach us about real-space DFT?
    N. Sobrino, D. Jacob, and S. Kurth
    J. Chem. Phys. 159, 154110 (2023).
18. 1178 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).
19. 1179 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).
20. 1180 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).