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6582 results: 6542 articles and 40 books or book chapters

1. 2641 A New Three-Dimensional Subsulfide Ir2In8S with Dirac Semimetal Behavior
   J. F. Khoury, A. J. E. Rettie, M. A. Khan, N. J. Ghimire, I. Robredo, J. E. Pfluger, K. Pal, C. Wolverton, A. Bergara, J. S. Jiang, L. M. Schoop, M. G. Vergniory, J. F. Mitchell, D. Y. Chung, and M. G. Kanatzidis
   J. Am. Chem. Soc. 141, 19130 (2019).
2. 2642 Two-Dimensional PC6 with Direct Band Gap and Anisotropic Carrier Mobility
   T. Yu, Z. Zhao, Y. Sun, A. Bergara, J. Lin, S. Zhang, H. Xu, L. Zhang, G. Yang, and Y. Liu
   J. Am. Chem. Soc. 141, 1599 (2019).
3. 2643 Interplay of Three G-Quadruplex Units in the KIT Promoter
   C. Ducani, G. Bernardinelli, B. Hogberg, B. K. Keppler, and A. Terenzi
   J. Am. Chem. Soc. 141, 10205 (2019).
4. 2644 Isolation of Transient Acyclic Germanium(I) Radicals Stabilized by Cyclic Alkyl(amino) Carbenes
   M. M. Siddiqui, S. K. Sarkar, S. Sinhababu, P. N. Ruth, R. Herbst-Irmer, D. Stalke, M. Ghosh, M. Fu, L. Zhao, D. Casanova, G. Frenking, B. Schwederski, W. Kaim, and H. W. Roesky
   J. Am. Chem. Soc. 141, 1908 (2019).
5. 2645 Transport properties of topologically non-trivial bismuth tellurobromides BinTeBr
   F. Pabst, D. Hobbis, N. Alzahrani, H. Wang, I. P. Rusinov, V. Chulkov, J. Martina, M. Ruck, and G. S. Nolas
   J. Appl. Phys. 126, 105105 (2019).
6. 2646 Role of the absorption on the spin-orbit interactions of light with Si nano-particles
   J. Olmos-Trigo, C. Sanz-Fernandez, D. R. Abujetas, A. Garcia-Etxarri, G. Molina-Terriza, J. A. Sanchez-Gil, F. Sebastian Bergeret, and J. Jose Saenz
   J. Appl. Phys. 126, 033104 (2019).
7. 2647 Narrow Fano resonances in Si nanocylinder metasurfaces: Refractive index sensing
   D. R. Abujetas, J. J. Saenz, and J. A. Sanchez-Gil
   J. Appl. Phys. 125, 183103 (2019).
8. 2648 Germanium as key dopant to boost the catalytic performance of small platinum clusters for alkane dehydrogenation
   E. Jimenez-Izal, J. -Y. Liu, and A. N. Alexandrova
   J. Catal. 374, 93 (2019).
9. 2649 MasterMSM: A Package for Constructing Master Equation Models of Molecular Dynamics
   D. de Sancho, and A. Aguirre
   J. Chem Inf. Model. 59, 3625 (2019).
10. 2650 An adiabatic connection for doubly-occupied configuration interaction wave functions
    N. Vu, I. Mitxelena, and I. I. I. Eugene DePrince
    J. Chem. Phys. 151, 244121 (2019).
11. 2651 Water dynamics in the hydration shells of biological and non-biological polymers
    S. Cerveny, and J. Swenson
    J. Chem. Phys. 150, 234904 (2019).
12. 2652 Motions of water and solutes-Slaving versus plasticization phenomena
    I. Combarro Palacios, C. Olsson, C. S. Kamma-Lorger, J. Swenson, and S. Cerveny
    J. Chem. Phys. 150, 124902 (2019).
13. 2653 Singlet fission in spiroconjugated dimers
    M. E. Sandoval-Salinas, A. Carreras, J. Casado, and D. Casanova
    J. Chem. Phys. 150, 204306 (2019).
14. 2654 Real-Time Propagation TDDFT and Density Analysis for Exciton Coupling Calculations in Large Systems
    J. Jornet-Somoza, and I. Lebedeva
    J. Chem. Theory Comput. 15, 3743 (2019).
15. 2655 Can Density Functional Theory Be Trusted for High-Order Electric Properties? The Case of Hydrogen-Bonded Complexes
    R. Zalesny, M. Medved, S. P. Sitkiewicz, E. Matito, and J. M. Luis
    J. Chem. Theory Comput. 15, 3570 (2019).
16. 2656 Photophysics of Molecular Aggregates from Excited State Diabatization
    A. Carreras, O. Uranga-Barandiaran, F. Castet, and D. Casanova
    J. Chem. Theory Comput. 15, 2320 (2019).
17. 2657 Toward Efficient GW Calculations Using Numerical Atomic Orbitals: Benchmarking and Application to Molecular Dynamics Simulations
    P. Koval, M. P. Ljungberg, M. Muller, and D. Sanchez-Portal
    J. Chem. Theory Comput. 15, 4564 (2019).
18. 2658 Far Red Fluorescent Proteins: Where Is the Limit of the Acylimine Chromophore?
    V. Moron, M. Marazzi, and M. Wanko
    J. Chem. Theory Comput. 15, 4228 (2019).
19. 2659 Colloidal systems chemistry. Replication, reproduction and selection at nanoscale
    M. Grzelczak
    J. Colloid Interface Sci. 537, 269 (2019).
20. 2660 Nine questions on energy decomposition analysis
    J. Andres, P. W. Ayers, R. A. Boto, R. Carbo-Dorca, H. Chermette, J. Cioslowski, J. Contreras-Garcia, D. L. Cooper, G. Frenking, C. Gatti, F. Heidar-Zadeh, L. Joubert, A. Martin Pendas, E. Matito, I. Mayer, A. J. Misquitta, Y. Mo, J. Pilme, P. L. A. Popelier, M. Rahm, et al.
    J. Comput. Chem. 40, 2248 (2019).