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Работы, на которые ссылается эта работа

Работ: 65

Работа: Adjustment of the Proton‐Accepting Ability of Π‐Bonds and Lone Pairs

  1. Multiwfn: A multifunctional wavefunction analyzer

    Tian Lu, Feiwu Chen

    Статья2011Цитирований: 110
    ABI

  2. The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

    Yan Zhao, Donald G. Truhlar

    Статья2007Цитирований: 29
    ABI

  3. The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

    Samuel Francis Boys, Fernando Bernardi

    Статья1970Цитирований: 25
    ABI

  4. Performance of M06, M06-2X, and M06-HF Density Functionals for Conformationally Flexible Anionic Clusters: M06 Functionals Perform Better than B3LYP for a Model System with Dispersion and Ionic Hydrogen-Bonding Interactions

    Martin Walker, Andrew J. A. Harvey, Ananya Sen +1

    Статья2013Цитирований: 17
    ABI

  5. Density Functional Theory and Hydrogen Bonds: Are We There Yet?

    A. Daniel Boese

    Статья2015Цитирований: 13
    ABI

  6. Hydrogen Bonding—New Insights

    Sławomir J. Grabowski

    Книга2006Цитирований: 11
    ABI

  7. Atoms in Molecules

    Richard F. W. Bader

    Книга1990Цитирований: 11
    ABI

  8. Communication: Density functional theory overcomes the failure of predicting intermolecular interaction energies

    Rafał Podeszwa, Krzysztof Szalewicz

    Статья2012Цитирований: 11
    ABI

  9. Influence of the Substituents on the CH...π Interaction: Benzene–Methane Complex

    S. Karthikeyan, V. Ramanathan, Brijesh Kumar Mishra

    Статья2013Цитирований: 11
    ABI

  10. Further analysis and comparative study of intermolecular interactions using dimers from the S22 database

    Laszlo Fusti Molnar, Xiao He, Bing Wang +1

    Статья2009Цитирований: 10
    ABI

  11. The structure and interaction energies of the weak complexes of CHClF2 and CHF3 with HCCH: a test of density functional theory methods

    Mark A. Vincent, Ian H. Hillier

    Статья2011Цитирований: 10
    ABI

  12. Can DFT and ab initio methods adequately describe binding energies in strongly interacting C6X6⋯C2X π–π complexes?

    Berthelot Saïd Duvalier Ramlina Vamhindi, Amir Karton

    Статья2017Цитирований: 10
    ABI

  13. OH<b><i>·</i></b><b><i>·</i></b><b><i>·</i></b>X (X = O, S) hydrogen bonding in thetrahydrofuran and tetrahydrothiophene

    Himansu S. Biswal, Sanjay Wategaonkar

    Статья2011Цитирований: 6
    ABI

  14. Definition of the hydrogen bond (IUPAC Recommendations 2011)

    E. Arunan, Gautam R. Desiraju, Roger A. Klein +11

    Статья2011Цитирований: 6
    ABI

  15. Toward Selection of Efficient Density Functionals for van der Waals Molecular Complexes: Comparative Study of C–H···π and N–H···π Interactions

    Guvanchmyrat Paytakov, T. C. Dinadayalane, Jerzy Leszczyński

    Статья2015Цитирований: 6
    ABI

  16. P <scp>SI4</scp> 1.4: Open-source software for high-throughput quantum chemistry

    Daniel G. A. Smith, Lori A. Burns, Andrew C. Simmonett +32

    Статья2020Цитирований: 6
    ABI

  17. Natural bond orbital analysis of molecular interactions: Theoretical studies of binary complexes of HF, H2O, NH3, N2, O2, F2, CO, and CO2 with HF, H2O, and NH3

    Alan E. Reed, Frank Weinhold, Larry A. Curtiss +1

    Статья1986Цитирований: 5
    ABI

  18. Intermolecular MH···HR Bonding in Monohydride Mo and W Complexes

    Galina Orlova, Steve Scheiner

    Статья1998Цитирований: 4
    ABI

  19. Natural bond orbital analysis of near-Hartree–Fock water dimer

    Alan E. Reed, Frank Weinhold

    Статья1983Цитирований: 3
    ABI

  20. Critical assessment of density functional methods for study of proton transfer processes. (FHF)−

    Zdzisław Latajka, Yves Bouteiller, Steve Scheiner

    Статья1995Цитирований: 3
    ABI

  21. The Hydrogen bond : recent developments in theory and experiments

    Peter Schuster, Georg Zuńdel, C. Sándorfy

    Книга1976Цитирований: 3
    ABI

  22. Comparison of Morokuma and perturbation theory approaches to decomposition of interaction energy. (NH4)+…NH3

    Sławomir M. Cybulski, Steve Scheiner

    Статья1990Цитирований: 3
    ABI

  23. Surfing π Clouds for Noncovalent Interactions: Arenes versus Alkenes

    Abil E. Aliev, Josephine R. T. Arendorf, Ilias Pavlakos +4

    Статья2014Цитирований: 3
    ABI

  24. Hydrogen-Bonding Acceptor Character of Be<sub>3</sub>, the Beryllium Three-Membered Ring

    Ibón Alkorta, Carlos Martín−Fernández, M. Merced Montero‐Campillo +1

    Статья2018Цитирований: 3
    ABI

  25. A−H…σ Hydrogen Bonds: Dihydrogen and Cycloalkanes as Proton Acceptors

    Sławomir J. Grabowski

    Статья2019Цитирований: 3
    ABI