검색결과 : 34건
| No. | Article |
|---|---|
| 1 |
Probing the Nature of Chemical Bonding in Uranyl(VI) Complexes with Quantum Chemical Methods Vallet V, Wahlgren U, Grenthe I Journal of Physical Chemistry A, 116(50), 12373, 2012 |
| 2 |
Charge Transfer in Uranyl(VI) Halides [UO2X4](2-) (X = F, Cl, Br, and I). A Quantum Chemical Study of the Absorption Spectra Ruiperez F, Wahlgren U Journal of Physical Chemistry A, 114(10), 3615, 2010 |
| 3 |
Solvent Effects on Uranium(VI) Fluoride and Hydroxide Complexes Studied by EXAFS and Quantum Chemistry (vol 40, pg 3519, 2001) Vallet V, Wahlgren U, Schimmelpfennig B, Moll H, Szabo Z, Grenthe I Inorganic Chemistry, 48(2), 781, 2009 |
| 4 |
Water Exchange Mechanism in the First Excited State of Hydrated Uranyl(VI) Wahlin P, Vallet V, Wahlgren U, Grenthe I Inorganic Chemistry, 48(23), 11310, 2009 |
| 5 |
An ab Initio Theoretical Study of the Electronic Structure of UO2+ and [UO2(CO3)(3)](5-) Ruiperez F, Danilo C, Real F, Flament JP, Vallet V, Wahlgren U Journal of Physical Chemistry A, 113(8), 1420, 2009 |
| 6 |
Ab initio study of the mechanism for photoinduced yl-oxygen exchange in uranyl(VI) in acidic aqueous solution Real F, Vallet V, Wahlgren U, Grenthe I Journal of the American Chemical Society, 130(35), 11742, 2008 |
| 7 |
Some quantum chemical aspects on outer-sphere electron-transfer reactions: The U(V)/Fe(III)-U(VI)/Fe(II) system Wahlgren U, Tsushima S, Grenthe I Journal of Physical Chemistry A, 110(29), 9025, 2006 |
| 8 |
Quantum chemical calculations of reduction potentials of AnO(2)(2+)/AnO(2)(+) (An = U, Np, Pu, Am) and Fe3+/Fe2+ couples Tsushima S, Wahlgren U, Grenthe I Journal of Physical Chemistry A, 110(29), 9175, 2006 |
| 9 |
Electron transfer in neptunyl(VI)-neptunyl(V) complexes in solution Macak P, Fromager E, Privalov T, Schimmelpfennig B, Grenthe I, Wahlgren U Journal of Physical Chemistry A, 109(22), 4950, 2005 |
| 10 |
Spin-orbit effects in electron transfer in neptunyl(VI)-neptunyl(V) complexes in solution Fromager E, Vallet V, Schimmelpfennig B, Macak P, Privalov T, Wahlgren U Journal of Physical Chemistry A, 109(22), 4957, 2005 |