Accurate calculation of the interaction energies in hydrogen-bonded complexes

被引:0
|
作者
Pedulla, JM [1 ]
Jordan, KD [1 ]
机构
[1] Univ Pittsburgh, Dept Chem, Pittsburgh, PA 15260 USA
关键词
D O I
暂无
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:35 / 44
页数:10
相关论文
共 50 条
  • [21] On the Optimization of the DF-SAPT-DFT Interaction Energies of Hydrogen-bonded Systems
    Czernek, Jiri
    PROCEEDINGS OF THE 9TH WSEAS INTERNATIONAL CONFERENCE ON SIMULATION, MODELLING AND OPTIMIZATION, 2009, : 237 - +
  • [22] Hydrogen-bonded complexes of pentaalkyl guanidines
    Rappo-Abiuso, M
    Llauro, MF
    Chevalier, Y
    Le Perchec, P
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2001, 3 (01) : 99 - 106
  • [23] ROTATIONAL SPECTRA OF HYDROGEN-BONDED COMPLEXES
    HERBINE, P
    ODUTOLA, A
    PRINSLOW, D
    VISWANATHAN, R
    DYKE, TR
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1983, 186 (AUG): : 106 - PHYS
  • [24] VIBRATIONAL PREDISSOCIATION IN HYDROGEN-BONDED COMPLEXES
    EWING, GE
    JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (03): : 2096 - 2107
  • [25] Chiral discrimination in hydrogen-bonded complexes
    Portmann, S
    Inauen, A
    Lüthi, HP
    Leutwyler, S
    JOURNAL OF CHEMICAL PHYSICS, 2000, 113 (21): : 9577 - 9585
  • [26] ABINITIO CALCULATIONS ON HYDROGEN-BONDED COMPLEXES
    BOTSCHWINA, P
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1991, 202 : 103 - PHYS
  • [27] Electron collisions with hydrogen-bonded complexes
    Freitas, T. C.
    Sanchez, S. d'A.
    Varella, M. T. do N.
    Bettega, M. H. F.
    PHYSICAL REVIEW A, 2011, 84 (06):
  • [28] Hydrogen-Bonded Complexes of Fluorophenylacetylenes: To Fluoresce or Not?
    Mondal, Sohidul Islam
    Dey, Arghya
    Patwari, G. Naresh
    CHEMPHYSCHEM, 2020, 21 (15) : 1711 - 1717
  • [29] Electrospun nanofibers of hydrogen-bonded complexes
    Selin, Victor
    Karimineghlani, Parvin
    Hlushko, Hanna
    Gaikwad, Adwait
    Sukhishvili, Svetlana
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2018, 256
  • [30] Hydrogen-bonded nickel(i) complexes
    Wilson, Jessica R.
    Zeller, Matthias
    Szymczak, Nathaniel K.
    CHEMICAL COMMUNICATIONS, 2021, 57 (06) : 753 - 756