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1

Structure of the hydrated dioxouranium(VI) ion in aqueous solution. An x-ray diffraction and proton NMR study

Aaberg, Maertha, Ferri, Diego, Glaser, Julius, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

1983

Language:

english

File:

PDF, 457 KB

english, 1983

2

Can Quantum Chemical Methods be used to Predict Gibbs Energies for Reactions in Solution? A Case Study using Binary and Ternary Lanthanide(III) and Actinide(III) - Tris[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione] (TTA) – Tributyl/Trimethyl phosphate (TBP/TMP) Complexes

Vallet, Valerie, Grenthe, Ingmar

Journal:

Solvent Extraction and Ion Exchange

Year:

2013

Language:

english

File:

PDF, 313 KB

english, 2013

3

On the Mechanism of Oxygen Exchange Between Uranyl(VI) Oxygen and Water in Strongly Alkaline Solution as Studied by 17 O NMR Magnetization Transfer

Szabó, Zoltán, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

2010

Language:

english

File:

PDF, 987 KB

english, 2010

4

Solvent Effects on Uranium(VI) Fluoride and Hydroxide Complexes Studied by EXAFS and Quantum Chemistry

Vallet, Valérie, Wahlgren, Ulf, Schimmelpfennig, Bernd, Moll, Henry, Szabó, Zoltán, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

2001

Language:

english

File:

PDF, 130 KB

english, 2001

5

In Memoriam: Sten Ahrland

Grenthe, Ingmar

Journal:

Reviews in Inorganic Chemistry

Year:

1999

Language:

english

File:

PDF, 154 KB

english, 1999

6

Chemical Thermodynamics of Uranium

Grenthe, Ingmar, Fuger, Jean, Lemire, Robert J, Canada, Manitoba, Muller, Anthony B, Wanner, Hans, Forest, Isabelle

Journal:

Year:

1992

Language:

english

File:

PDF, 4.08 MB

english, 1992

7

On the use of semiempirical electrolyte theories for modeling of solution chemical data

Grenthe, Ingmar, Plyasunov, A.

Journal:

Pure & Applied Chemistry

Year:

1997

Language:

english

File:

PDF, 446 KB

english, 1997

8

Comment on “The Water-Exchange Mechanism of the [UO2(OH2)5]2+ Ion Revisited: The Importance of a Proper Treatment of Electron Correlation” [F. P. Rotzinger Chem. Eur. J., 2007, 13, 800]

Valérie Vallet, Ulf Wahlgren, Ingmar Grenthe

Journal:

Chemistry - A European Journal

Year:

2007

Language:

english

File:

PDF, 210 KB

english, 2007

9

ChemInform Abstract: Solvent Effects on Uranium(VI) Fluoride and Hydroxide Complexes Studied by EXAFS and Quantum Chemistry.

Valerie Vallet, Ulf Wahlgren, Bernd Schimmelpfennig, Henry Moll, Zoltan Szabo, Ingmar Grenthe

Journal:

Year:

2001

File:

PDF, 35 KB

2001

10

Rates and Mechanism of Fluoride and Water Exchange in UO2F53- and [UO2F4(H2O)]2- Studied by NMR Spectroscopy and Wave Function Based Methods.

Valerie Vallet, Ulf Wahlgren, Zoltan Szabo, Ingmar Grenthe

Journal:

Year:

2002

File:

PDF, 33 KB

2002

11

Reduction of Uranyl(VI) by Iron(II) in Solutions: An ab initio Study.

Timofei Privalov, Bernd Schimmelpfennig, Ulf Wahlgren, Ingmar Grenthe

Journal:

Year:

2003

File:

PDF, 72 KB

2003

12

The Mechanism of Water Exchange in AmO2(H2O)52+ and in the Isoelectronic UO2(H2O)5+ and NpO2(H2O)52+ Complexes as Studied by Quantum Chemical Methods.

Valerie Vallet, Timofei Privalov, Ulf Wahlgren, Ingmar Grenthe

Journal:

Year:

2004

File:

PDF, 53 KB

2004

13

Electron Transfer in Uranyl(VI)-Uranyl(V) Complexes in Solution.

Timofei Privalov, Peter Macak, Bernd Schimmelpfennig, Emmanuel Fromager, Ingmar Grenthe, Ulf Wahlgren

Journal:

Year:

2004

Language:

english

File:

PDF, 12 KB

english, 2004

14

Experimental and Quantum Chemical Studies of Structure and Reaction Mechanisms of Dioxouranium(VI) Complexes in Solution

Valerie Vallet, Zoltan Szabo, Ingmar Grenthe

Journal:

Year:

2005

File:

PDF, 8 KB

2005

15

Solution coordination chemistry of actinides: Thermodynamics, structure and reaction mechanisms

Zoltan Szabó, Takashi Toraishi, Valerie Vallet, Ingmar Grenthe

Journal:

Coordination Chemistry Reviews

Year:

2006

Language:

english

File:

PDF, 1.25 MB

english, 2006

16

Confirmation of the structure of (UO2)3(CO3)66− by 17O NMR

Deigo Ferri, Julius Glaser, Ingmar Grenthe

Journal:

Inorganica Chimica Acta

Year:

1988

Language:

english

File:

PDF, 117 KB

english, 1988

17

Kinetic studies of mixed complexes between lanthanoid EDTA and 5-sulfosalicylate

Carl-Gustav Ekström, Lena Nilsson, Ingmar Grenthe

Journal:

Inorganica Chimica Acta

Year:

1981

Language:

english

File:

PDF, 653 KB

english, 1981

18

The rate and mechanism for the formation of mixed complexes between lanthanoid EDTA and pyridine-2-carboxylate or 8-hydroxyquinoline-5-sulfonate

Carl-Gustav Ekström, Lena Nilsson, Ian A. Duncan, Ingmar Grenthe

Journal:

Inorganica Chimica Acta

Year:

1980

Language:

english

File:

PDF, 765 KB

english, 1980

19

Reduction of uranyl by hydrogen: an ab initio study

Valérie Vallet, Bernd Schimmelpfennig, Laurent Maron, Christian Teichteil, Thierry Leininger, Odd Gropen, Ingmar Grenthe, Ulf Wahlgren

Journal:

Chemical Physics

Year:

1999

Language:

english

File:

PDF, 90 KB

english, 1999

20

On the combined use of discrete solvent models and continuum descriptions of solvent effects in ligand exchange reactions: a case study of the uranyl(VI) aquo ion

Pernilla Wåhlin, Bernd Schimmelpfennig, Ulf Wahlgren, Ingmar Grenthe, Valérie Vallet

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2009

Language:

english

File:

PDF, 249 KB

english, 2009

21

On the structure and relative stability of uranyl(VI) sulfate complexes in solution

Valérie Vallet, Ingmar Grenthe

Journal:

Comptes Rendus Chimie

Year:

2007

Language:

english

File:

PDF, 365 KB

english, 2007

22

Solution studies of systems with polynuclear complex formation. 3. The cadmium(II) citrate system

Ingmar Grenthe, Peter Wikberg, Ebbe R. Still

Journal:

Inorganica Chimica Acta

Year:

1984

Language:

english

File:

PDF, 767 KB

english, 1984

23

Actinide Chemistry in Solution, Quantum Chemical Methods and Models

Valerie Vallet, Peter Macak, Ulf Wahlgren, Ingmar Grenthe

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2006

Language:

english

File:

PDF, 215 KB

english, 2006

24

Chemical equilibria in the uranyl(vi)–peroxide–carbonate system; identification of precursors for the formation of poly-peroxometallates

Zanonato, Pier Luigi, Di Bernardo, Plinio, Szabó, Zoltán, Grenthe, Ingmar

Journal:

Dalton Transactions

Year:

2012

Language:

english

File:

PDF, 1.23 MB

english, 2012

25

Ab Initio Studies of Np and Pu Complexes and Reactions in the Gas Phase: Structures and Thermodynamics

Schimmelpfennig, Bernd, Privalov, Timofei, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 59 KB

english, 2003

26

Time-Resolved Laser-Induced Fluorescence of Uranium(VI) Hydroxo-Complexes at Different Temperatures

Eliet, Veronique, Grenthe, Ingmar, Bidoglio, Giovanni

Journal:

Applied Spectroscopy

Year:

2000

Language:

english

File:

PDF, 206 KB

english, 2000

27

Nitrito-nitro linkage isomerization in the solid state. 2. A comparative study of the structures of nitrito- and nitropentaaminecobalt(III) dichloride

Grenthe, Ingmar, Nordin, Ellika

Journal:

Inorganic Chemistry

Year:

1979

Language:

english

File:

PDF, 731 KB

english, 1979

28

Nitrito-nitro linkage isomerization in the solid state. 1. X-ray crystallographic studies of trans-bis(ethylenediamine)(isothiocyanato)nitrito- and trans-bis(ethylenediamine)(isothiocyanato)nitrocobalt(III) perchlorate and iodide

Grenthe, Ingmar, Nordin, Ellika

Journal:

Inorganic Chemistry

Year:

1979

Language:

english

File:

PDF, 834 KB

english, 1979

29

Nanostructured hard material composites by molecular engineering 1. Synthesis from soluble tungstate salts

Sverker Wahlberg, Ingmar Grenthe, Mamoun Muhammed

Journal:

Nanostructured Materials

Year:

1997

Language:

english

File:

PDF, 202 KB

english, 1997

30

Probing the Nature of Chemical Bonding in Uranyl(VI) Complexes with Quantum Chemical Methods

Vallet, Valérie, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2012

Language:

english

File:

PDF, 1.81 MB

english, 2012

31

The temperature dependence of stability constants for the formation of polynuclear cationic complexes

Andrey V. Plyasunov, Ingmar Grenthe

Journal:

Geochimica et Cosmochimica Acta

Year:

1994

Language:

english

File:

PDF, 2.17 MB

english, 1994

32

On the influence of carbonate on mineral dissolution: III. The solubility of microcrystalline ThO2 in CO2-H2O media

Erik Östhols, Jordi Bruno, Ingmar Grenthe

Journal:

Geochimica et Cosmochimica Acta

Year:

1994

Language:

english

File:

PDF, 1.23 MB

english, 1994

33

Kinetics of Ligand Exchange Reactions for Uranyl(2+) Fluoride Complexes in Aqueous Solution

Szabó, Zoltán, Glaser, Julius, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

1996

Language:

english

File:

PDF, 192 KB

english, 1996

34

Stability Relationships Among the Rare Earth Acetylacetonates

Grenthe, Ingmar, Fernelius, W. Conard

Journal:

Journal of the American Chemical Society

Year:

1960

Language:

english

File:

PDF, 365 KB

english, 1960

35

Characterisation of hydroxide complexes of uranium(VI) by time-resolved fluorescence spectroscopy

Eliet, V�ronique, Bidoglio, Giovanni, Omenetto, Nicol�, Parma, Ludvik, Grenthe, Ingmar

Journal:

Journal of the Chemical Society Faraday Transactions

Year:

1995

Language:

english

File:

PDF, 1.38 MB

english, 1995

36

Electron Transfer in Uranyl(VI)−Uranyl(V) Complexes in Solution

Privalov, Timofei, Macak, Peter, Schimmelpfennig, Bernd, Fromager, Emmanuel, Grenthe, Ingmar, Wahlgren, Ulf

Journal:

Journal of the American Chemical Society

Year:

2004

Language:

english

File:

PDF, 103 KB

english, 2004

37

Stability Relationships Among the Rare Earth Dipicolinates

Grenthe, Ingmar

Journal:

Journal of the American Chemical Society

Year:

1961

Language:

english

File:

PDF, 499 KB

english, 1961

38

Rates and Mechanisms of Water Exchange of UO 22+ (aq) and UO 2 (oxalate)F(H 2 O) 2- : A Variable-Temperature 17 O and 19 F NMR Study

Farkas, Ildikó, Bányai, István, Szabó, Zoltán, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

2000

Language:

english

File:

PDF, 94 KB

english, 2000

39

Structure and Thermodynamics of Uranium(VI) Complexes in the Gas Phase: A Comparison of Experimental and ab Initio Data

Privalov, Timofei, Schimmelpfennig, Bernd, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 66 KB

english, 2002

40

Mechanisms of Ligand Exchange Reactions, A Quantum Chemical Study of the Reaction UO 22+ (Aq) + HF(Aq) → UO 2 F + (Aq) + H + (Aq)

Toraishi, Takashi, Privalov, Timofei, Schimmelpfennig, Bernd, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 102 KB

english, 2003

41

Chemical equilibria in the UO22+–H2O2–F−/OH− systems and possible solution precursors for the formation of [Na6(OH2)8]@[UO2(O2)F]2418− and [Na6(OH2)8]@[UO2(O2)OH]2418− clusters

Zanonato, Pier Luigi, Di Bernardo, Plinio, Fischer, Andreas, Grenthe, Ingmar

Journal:

Dalton Transactions

Year:

2013

Language:

english

File:

PDF, 2.71 MB

english, 2013

42

Structure and Bonding in Solution of Dioxouranium(VI) Oxalate Complexes: Isomers and Intramolecular Ligand Exchange

Vallet, Valérie, Moll, Henry, Wahlgren, Ulf, Szabó, Zoltán, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

2003

Language:

english

File:

PDF, 273 KB

english, 2003

43

Structure and dynamics of binary and ternary lanthanide(iii) and actinide(iii) tris[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedione] (TTA) – tributylphosphate (TBP) complexes. Part 3, the structure, thermodynamics and reaction mechanisms of 8- and 9-coordinated binary and ternary Y-TTA-TBP complexes studied by quantum chemical methods

Vallet, Valerie, Szabó, Zoltán, Grenthe, Ingmar

Journal:

Dalton Transactions

Year:

2011

Language:

english

File:

PDF, 714 KB

english, 2011

44

Some Quantum Chemical Aspects on Outer-Sphere Electron-Transfer Reactions: The U(V)/Fe(III)−U(VI)/Fe(II) System

Wahlgren, Ulf, Tsushima, Satoru, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 56 KB

english, 2006

45

Mechanisms of Ligand Substitution Reactions in Ternary Dioxouranium(VI) Complexes

Szabó, Zoltán, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

1998

Language:

english

File:

PDF, 139 KB

english, 1998

46

Quantum Chemical Calculations of Reduction Potentials of AnO 22+ /AnO 2+ (An = U, Np, Pu, Am) and Fe 3+ /Fe 2+ Couples

Tsushima, Satoru, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 186 KB

english, 2006

47

Structure and Bonding in Solution of Dioxouranium(VI) Oxalate Complexes: Isomers and Intramolecular Ligand Exchange

Vallet, Valérie, Moll, Henry, Wahlgren, Ulf, Szabó, Zoltán, Grenthe, Ingmar

Journal:

Inorganic Chemistry

Year:

2003

Language:

english

File:

PDF, 17 KB

english, 2003

48

Reduction of Uranyl(VI) by Iron(II) in Solutions: An Ab Initio Study

Privalov, Timofei, Schimmelpfennig, Bernd, Wahlgren, Ulf, Grenthe, Ingmar

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 61 KB

english, 2003

49

Electron Transfer in Neptunyl(VI)−Neptunyl(V) Complexes in Solution

Macak, Peter, Fromager, Emmanuel, Privalov, Timofei, Schimmelpfennig, Bernd, Grenthe, Ingmar, Wahlgren, Ulf

Journal:

Journal of Physical Chemistry A

Year:

2005

Language:

english

File:

PDF, 145 KB

english, 2005

50

Use of thermal lensing spectrophotometry (TLS) for the study of mononuclear hydrolysis of uranium(IV)

Grenthe, Ingmar, Bidoglio, Giovanni, Omenetto, Nicolo

Journal:

Inorganic Chemistry

Year:

1989

Language:

english

File:

PDF, 457 KB

english, 1989