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6838 results: 6800 articles and 38 books or book chapters

1. 1641 Zinc glycolate Zn(OCH2CH2O): Synthesis and structure, spectral and optical properties, electronic structure and chemical bonding
   V. N. Krasil'nikov, A. P. Tyutyunnik, V. P. Zhukov, I. V. Baklanova, O. I. Gyrdasova, and E. V. Chulkov
   J. Alloy. Compd. 924, 166320 (2022).
2. 1642 A molecular dynamics study of N-A-S-H gel with various Si/Al ratios
   Y. Chen, J. S. Dolado, Z. Li, S. Yin, Q. Yu, A. Kostiuchenko, and G. Ye
   J. Am. Ceram. Soc. 105, 6462 (2022).
3. 1643 Preparation, Supramolecular Organization, and On-Surface Reactivity of Enantiopure Subphthalocyanines: From Bulk to 2D-Polymerization
   J. Labella, G. Lavarda, L. Hernandez-Lopez, F. Aguilar-Galindo, S. Diaz-Tendero, J. Lobo-Checa, and T. Torres
   J. Am. Chem. Soc. 144, 16579 (2022).
4. 1644 Steric Hindrance of NH3 Diffusion on Pt(111) by Co-Adsorbed O-Atoms
   D. Borodin, O. Galparsoro, I. Rahinov, J. Fingerhut, M. Schwarzer, S. Horandl, D. J. Auerbach, A. Kandratsenka, D. Schwarzer, T. N. Kitsopoulos, and A. M. Wodtke
   J. Am. Chem. Soc. 144, 21791 (2022).
5. 1645 Structure Matters: Asymmetric CO Oxidation at Rh Steps with Different Atomic Packing
   F. Garcia-Martinez, L. Raemisch, K. Ali, I. Waluyo, R. C. Bodero, S. Pfaff, I. J. Villar-Garcia, A. L. Walter, A. Hunt, V. Perez-Dieste, J. Zetterberg, E. Lundgren, F. Schiller, and J. E. Ortega
   J. Am. Chem. Soc. 144, 15363 (2022).
6. 1646 Generation and Characterization of the Charge-Transferred Diradical Complex CaCO2 with an Open-Shell Singlet Ground State
   Y. Zhou, S. Pan, X. Dong, L. Wang, M. Zhou, and G. Frenking
   J. Am. Chem. Soc. 144, 8355 (2022).
7. 1647 Chemisorption-Induced Formation of Biphenylene Dimer on Ag(111)
   Z. Zeng, D. Guo, T. Wang, Q. Chen, A. Matej, J. Huang, D. Han, Q. Xu, A. Zhao, P. Jelinek, D. G. de Oteyza, J. -S. Mcewen, and J. Zhu
   J. Am. Chem. Soc. 144, 723 (2022).
8. 1648 Aza-Triangulene: On-Surface Synthesis and Electronic and Magnetic Properties
   T. Wang, A. Berdonces-Layunta, N. Friedrich, M. Vilas-Varela, J. Patrick Calupitan, J. Ignacio Pascual, D. Pena, D. Casanova, M. Corso, and D. G. de Oteyza
   J. Am. Chem. Soc. 144, 4522 (2022).
9. 1649 Solid-State Pathway Control via Reaction-Directing Heteroatoms: Ordered Pyridazine Nanothreads through Selective Cycloaddition
   S. G. Dunning, L. Zhu, B. Chen, S. Chariton, V. B. Prakapenka, M. Somayazulu, and T. A. Strobel
   J. Am. Chem. Soc. 144, 2073 (2022).
10. 1650 Theoretical studies of furan and thiophene nanothreads: structures, cycloaddition barriers, and activation volumes
    B. Chen, V. H. Crespi, and R. Hoffmann
    J. Am. Chem. Soc. 144, 9044 (2022).
11. 1651 Phenanthrene-Extended Phenazine Dication: An Electrochromic Conformational Switch Presenting Dual Reactivity
    J. Dosso, B. Bartolomei, N. Demitri, F. P. Cossio, and M. Prato
    J. Am. Chem. Soc. 144, 7295 (2022).
12. 1652 Active site dynamics and catalytic mechanism in arabinan hydrolysis catalyzed by GH43 endo-arabinanase from QM/MM molecular dynamics simulation and potential energy surface
    W. Meelua, T. Wanjai, N. Thinkumrob, J. Olah, I. Mujika, J. R. Ketudat-Cairns, S. Hannongbua, and J. Jitonnom
    J. Biomol. Struct. Dyn. 40, 7439 (2022).
13. 1653 AMBER Drug Discovery Boost Tools: Automated Workflow for Production Free-Energy Simulation Setup and Analysis (ProFESSA)
    A. Ganguly, H. -C. Tsai, M. Fernandez-Pendas, T. -S. Lee, T. J. Giese, and D. M. York
    J. Chem Inf. Model. 62, 6069 (2022).
14. 1654 The Wigner localization of interacting electrons in a one-dimensionalharmonic potential
    X. Telleria-Allika, M. E. Azor, G. Francois, G. L. Bendazzoli, J. M. Matxain, X. Lopez, S. Evangelisti, and J. A. Berger
    J. Chem. Phys. 157, 174107 (2022).
15. 1655 Superconducting Li10Se electride under pressure
    X. Zhang, Y. Zhao, A. Bergara, and G. Yang
    J. Chem. Phys. 156, 194112 (2022).
16. 1656 Simple evaluation of dynamic disorder effects on exciton transport
    A. Carreras, and D. Casanova
    J. Chem. Phys. 156, 044112 (2022).
17. 1657 Adiabatic electronic flux in molecules and in condensed matter
    R. Resta
    J. Chem. Phys. 156, 204118 (2022).
18. 1658 Studying and exploring potential energy surfaces of compressedmolecules: A fresh theory from the extreme pressure polarizablecontinuum model
    R. Cammi, and B. Chen
    J. Chem. Phys. 157, 114101 (2022).
19. 1659 The nature of the polar covalent bond
    L. Zhao, S. Pan, and G. Frenking
    J. Chem. Phys. 157, 034105 (2022).
20. 1660 Natural range separation of the Coulomb hole
    M. Via-Nadal, M. Rodriguez-Mayorga, E. Ramos-Cordoba, and E. Matito
    J. Chem. Phys. 156, 184106 (2022).