## Abstract A simulation of phosphate in aqueous solution was carried out employing the new QMCF MD approach which offers the possibility to investigate composite systems with the accuracy of a QMMM method but without the time consuming creation of soluteβsolvent potential functions. The data of th
Reduction of Uranyl(VI) by Iron(II) in Solutions: An ab initio Study.
β Scribed by Timofei Privalov; Bernd Schimmelpfennig; Ulf Wahlgren; Ingmar Grenthe
- Publisher
- John Wiley and Sons
- Year
- 2003
- Weight
- 72 KB
- Volume
- 34
- Category
- Article
- ISSN
- 0931-7597
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