Ab-initio and DFT Study of the Molecular Mechanisms of SO3 and SOCl2 Reactions with Water in the Gas Phase

被引:0
|
作者
Alfred Wegener Inst. Polar-/Mar. R., Bremerhaven, Germany [1 ]
不详 [2 ]
不详 [3 ]
不详 [4 ]
机构
来源
| 1600年 / 3642-3649卷 / April 22, 2004期
关键词
Theoretical; (THR); -; Experimental; (EXP);
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
相关论文
共 50 条
  • [1] Ab-initio and DFT study of the molecular mechanisms of SO3 and SOCl2 reactions with water in the gas phase
    Ignatov, SK
    Sennikov, PG
    Razuvaev, AG
    Schrems, O
    JOURNAL OF PHYSICAL CHEMISTRY A, 2004, 108 (16): : 3642 - 3649
  • [4] PASSIVATION KINETICS OF LI IN SOCL2, SO2CL2, AND SO3 SOLUTIONS
    MOGENSEN, M
    JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 1987, 134 (8B) : C404 - C404
  • [5] Ab initio study on the molecular structure and spectroscopic properties of isomers of SO3
    Chi, Lihan
    Wang, Meishan
    Yang, Chuanlu
    Liu, Yanli
    Ma, Shanshan
    Ma, Xiaoguang
    SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2020, 242
  • [6] SO2Cl2, SOCl2:: energy dispersive X-ray diffraction, ab initio and molecular dynamics calculation
    Meloni, S
    Pieretti, A
    Bencivenni, L
    Albertini, VR
    Sadun, C
    Caminiti, R
    COMPUTATIONAL MATERIALS SCIENCE, 2001, 20 (3-4) : 407 - 415
  • [7] Serendipitous formation of the cyclic sulfite DIMTH(SO3) by reaction of DIMTH(OH)2 with SOCl2
    Handrosch, Carsten
    Heinemann, Frank W.
    Kisch, Horst
    Zeitschrift fur Naturforschung - Section B Journal of Chemical Sciences, 1999, 54 (08): : 1015 - 1018
  • [8] Serendipitous formation of the cyclic sulfite DIMTH(SO3) by reaction of DIMTH(OH)2 with SOCl2
    Handrosch, C
    Heinemann, FW
    Kisch, H
    ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 1999, 54 (08): : 1015 - 1018
  • [9] AB-INITIO MOLECULAR-ORBITAL STUDY OF THE MECHANISM OF THE GAS-PHASE REACTION SO3+H2O - IMPORTANCE OF THE 2ND WATER MOLECULE
    MOROKUMA, K
    MUGURUMA, C
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1994, 116 (22) : 10316 - 10317
  • [10] AB-INITIO STUDY OF THE SUBSTITUENT EFFECTS OF CARBENE RADICAL REACTIONS WITH WATER
    GONZALEZ, C
    RESTREPO, A
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1995, 210 : 145 - COMP