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Van der waals vs london dispersio organic chemistry
Van der waals vs london dispersio organic chemistry








Probing the Delicate Balance between Pauli Repulsion and London Dispersion with Triphenylmethyl Derivatives.

  • Sören Rösel, Jonathan Becker, Wesley D.
  • Journal of Chemical Theory and Computation 2019, 15 Effect of Electron Correlation on Intermolecular Interactions: A Pair Natural Orbitals Coupled Cluster Based Local Energy Decomposition Study.
  • Ahmet Altun, Frank Neese, Giovanni Bistoni.
  • Role of London Dispersion Interactions in Ga-Substituted Dipnictenes.
  • Lijuan Song, Juliane Schoening, Christoph Wölper, Stephan Schulz, Peter R.
  • The Journal of Physical Chemistry A 2019, 123 Toward a Quantum-Chemical Benchmark Set for Enzymatically Catalyzed Reactions: Important Steps and Insights. Journal of Chemical Theory and Computation 2019, 15Ī. HFLD: A Nonempirical London Dispersion-Corrected Hartree–Fock Method for the Quantification and Analysis of Noncovalent Interaction Energies of Large Molecular Systems. Irreversible Thermochromism in Organic Salts of Sulfonated Anils. Layer-by-Layer Epitaxy of Porphyrin−Ligand Fe(II)-Fe(III) Nanoarchitectures for Advanced Metal–Organic Framework Growth. Barth, Xiao Lin, Francesco Allegretti, Shixuan Du, Carlos-Andres Palma. Deimel, Yan Wang, Shuai Zhang, Xiaoxi Zhang, Vishal Gupta, Juan Li, Hong-Jun Gao, David A.
  • Zishu Wang, Kai Qian, Murat Anil Öner, Peter S.
  • Enantioselectivity in the Noyori–Ikariya Asymmetric Transfer Hydrogenation of Ketones. Journal of Chemical Theory and Computation 2021, 17 CHA元36 Benchmark Set: How Well Do Quantum-Chemical Methods Describe Chalcogen-Bonding Interactions?.
  • Nisha Mehta, Thomas Fellowes, Jonathan M.
  • The Journal of Physical Chemistry A 2021, 125 Understanding the Nature and Properties of Hydrogen–Hydrogen Bonds: The Stability of a Bulky Phosphatetrahedrane as a Case Study. Journal of the American Chemical Society 2021, 143 Could London Dispersion Force Control Regioselective (2 + 2) Cyclodimerizations of Benzynes? YES: Application to the Synthesis of Helical Biphenylenes.
  • Takashi Ikawa, Yuta Yamamoto, Akito Heguri, Yutaka Fukumoto, Tomonari Murakami, Akira Takagi, Yuto Masuda, Kenzo Yahata, Hiroshi Aoyama, Yasuteru Shigeta, Hiroaki Tokiwa, Shuji Akai.
  • London Dispersion Helps Refine Steric A-Values: Dispersion Energy Donor Scales. Computational Evaluation and Design of Polyethylene Zirconocene Catalysts with Noncovalent Dispersion Interactions. Journal of Chemical Theory and Computation 2022, 18 Open-Shell Variant of the London Dispersion-Corrected Hartree–Fock Method (HFLD) for the Quantification and Analysis of Noncovalent Interaction Energies.

    van der waals vs london dispersio organic chemistry van der waals vs london dispersio organic chemistry

    Journal of the American Chemical Society 2022, 144 Increasing Complexity in a Conformer Space Step-by-Step: Weighing London Dispersion against Cation−π Interactions. Vladimir Gorbachev, Alexandra Tsybizova, Larisa Miloglyadova, Peter Chen.Synthetic Doping of Diamondoids through Skeletal Editing. Tilting the Balance: London Dispersion Systematically Enhances Enantioselectivities in Brønsted Acid Catalyzed Transfer Hydrogenation of Imines.

    van der waals vs london dispersio organic chemistry

    Johannes Gramüller, Maximilian Franta, Ruth M.This article is cited by 92 publications.










    Van der waals vs london dispersio organic chemistry