Structure and water exchange of the hydrated thiosulfate ion in aqueous solution using QMCF MD simulation and large angle X-ray scattering

2014 ◽  
Vol 43 (33) ◽  
pp. 12711-12720 ◽  
Author(s):  
Lars Eklund ◽  
Tomas S. Hofer ◽  
Alexander K. H. Weiss ◽  
Andreas O. Tirler ◽  
Ingmar Persson
Keyword(s):  
Aqueous Solution ◽  
Sulfur Atom ◽  
Md Simulation ◽  
Water Exchange ◽  
Large Angle ◽  
Sulfate Ion ◽  
Simulation Data ◽  
X Ray ◽  
X Ray Scattering ◽  
Hydration Structure

Experimental and simulation data of the thiosulfate ion show large similarities in hydration structure and mechanism with the sulfate ion but with weaker hydration of the terminal sulfur atom in thiosulfate.

scholarly journals Structure and water exchange dynamics of hydrated oxo halo ions in aqueous solution using QMCF MD simulation, large angle X-ray scattering and EXAFS

2015 ◽  
Vol 44 (4) ◽  
pp. 1816-1828 ◽  
Author(s):  
Lars Eklund ◽  
Tomas S. Hofer ◽  
Ingmar Persson
Keyword(s):  
Aqueous Solution ◽  
Md Simulation ◽  
Water Exchange ◽  
Pure Water ◽  
Large Angle ◽  
Water Molecules ◽  
Surrounding Water ◽  
X Ray ◽  
X Ray Scattering ◽  
Ray Methods

The structure and water exchange dynamics of the hydrated oxo halo ions in aqueous solution, studied by QMCF MD simulation and experimental X-ray methods, show that they are all structure breakers, thus the hydrogen bonding between the ion and surrounding water molecules is weaker than between water molecules in pure water.

The Structure of the Hydrated Gallium(III), Indium(III), and Chromium(III) Ions in Aqueous Solution. A Large Angle X-ray Scattering and EXAFS Study

1998 ◽  
Vol 37 (26) ◽  
pp. 6675-6683 ◽  
Author(s):  
Patric Lindqvist-Reis ◽  
Adela Muñoz-Páez ◽  
Sofia Díaz-Moreno ◽  
Sidhartha Pattanaik ◽  
Ingmar Persson ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Large Angle ◽  
X Ray ◽  
X Ray Scattering ◽  
Exafs Study ◽  
Ray Scattering

scholarly journals Second-Sphere Hydration of Rhodium(III) and Chromium(III) in Aqueous Solution. A Large-Angle X-Ray Scattering and EXAFS Study.

1992 ◽  
Vol 46 ◽  
pp. 1177-1182 ◽  
Author(s):  
Michael C. Read ◽  
Magnus Sandström ◽  
Antonio de la Hoz ◽  
Johan Springborg ◽  
Markku R. Sundberg ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Large Angle ◽  
X Ray ◽  
X Ray Scattering ◽  
Exafs Study ◽  
Ray Scattering

scholarly journals A Large-angle X-Ray Scattering Study of 9-Molybdomonophosphate Complexes in Aqueous Solution.

1978 ◽  
Vol 32a ◽  
pp. 407-414 ◽  
Author(s):  
Georg Johansson ◽  
Lage Pettersson ◽  
Nils Ingri ◽  
Elina Näsäkkälä ◽  
Otto Bastiansen ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Large Angle ◽  
X Ray ◽  
X Ray Scattering ◽  
Scattering Study ◽  
Ray Scattering
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