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1

Handbook of Molecular Physics and Quantum Chemistry. Band 1–3. Herausgegeben von Stephen Wilson, Peter F. Bernath und Roy McWeeny.

Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2003

Language:

german

File:

PDF, 73 KB

german, 2003

2

Low-Valent Silicon Cations with Two-Coordinate Silicon and Aromatic Character

Matthias Driess, Shenglai Yao, Markus Brym, Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2006

Language:

english

File:

PDF, 110 KB

english, 2006

3

A Heterofulvene-Like Germylene with a Betain Reactivity

Matthias Driess, Shenglai Yao, Markus Brym, Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2006

Language:

english

File:

PDF, 124 KB

english, 2006

4

Electron correlation, molecular properties and relativity – A tribute to Werner Kutzelnigg

Christoph van Wüllen, Wim Klopper, Debashis Mukherjee

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 132 KB

english, 2009

5

Two-component relativistic density functional theory modeling of the adsorption of element 114(eka-lead) on gold

Zaitsevskii, Andréi, van Wüllen, Christoph, Rykova, Elena A., Titov, Anatoly V.

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 958 KB

english, 2010

6

A New Type of N-Heterocyclic Silylene with Ambivalent Reactivity

Driess, Matthias, Yao, Shenglai, Brym, Markus, van Wüllen, Christoph, Lentz, Dieter

Journal:

Journal of the American Chemical Society

Year:

2006

Language:

english

File:

PDF, 57 KB

english, 2006

7

Magnetic anisotropy through cooperativity in multinuclear transition metal complexes: theoretical investigation of an anisotropic exchange mechanism

van Wüllen, Christoph

Journal:

Molecular Physics

Year:

2013

Language:

english

File:

PDF, 179 KB

english, 2013

8

Editorial of the PCCP themed issue on “Physical Chemistry for Life Sciences”

van Wüllen, Christoph, Schwing, Kirsten, Riehn, Christoph, Gerhards, Markus

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.31 MB

english, 2017

9

Magnetostructural correlation in isolated trinuclear iron( iii ) oxo acetate complexes

Lang, Johannes, Hewer, Joachim M., Meyer, Jonathan, Schuchmann, Jonas, van Wüllen, Christoph, Niedner-Schatteburg, Gereon

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 3.45 MB

english, 2018

10

Magnetic Moments of Small Cobalt Clusters Revisited: The Contribution of 3d and 4s Electrons

Heimermann, Andreas, van Wüllen, Christoph

Journal:

International Journal of Mass Spectrometry

Year:

2019

Language:

english

File:

PDF, 5.61 MB

english, 2019

11

On the use of common effective core potentials in density functional calculations. I. Test calculations on transition-metal carbonyls

Christoph van Wüllen

Journal:

International Journal of Quantum Chemistry

Year:

1996

Language:

english

File:

PDF, 456 KB

english, 1996

12

η5-Pentamethylcyclopentadienyliridium(III) and -rhodium(III) Labeling of Amino Acids with Aromatic Side Chains – The Importance of Relativistic Effects for the Stability of Cp*Irııı Sandwich Complexes

Diran Agaid Herebian, Claudia S. Schmidt, William S. Sheldrick, Christoph van Wüllen

Journal:

European Journal of Inorganic Chemistry

Year:

1998

Language:

english

File:

PDF, 225 KB

english, 1998

13

van't-Hoff-Le-Bel-Fremdling: Bildung eines Phosphoniumkations mit einem planar-tetrakoordinierten Phosphoratom

Matthias Driess, Joachim Aust, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

1999

Language:

german

File:

PDF, 108 KB

german, 1999

14

van't Hoff–Le Bel Stranger: Formation of a Phosphonium Cation with a Planar Tetracoordinate Phosphorus Atom

Matthias Driess, Joachim Aust, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

1999

Language:

english

File:

PDF, 111 KB

english, 1999

15

Titelbild

Matthias Driess, Christian Monsé, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2000

File:

PDF, 27 KB

2000

16

Perstannylierte Ammonium- und Phosphoniumionen: metallorganische Onium- und gleichzeitig basenstabilisierte Stannyliumionen

Matthias Driess, Christian Monsé, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2000

Language:

german

File:

PDF, 142 KB

german, 2000

17

Cover Picture

Matthias Driess, Christian Monsé, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2000

File:

PDF, 28 KB

2000

18

Perstannylated Ammonium and Phosphonium Ions: Organometallic Onium Ions That Are also Base-Stabilized Stannylium Ions

Matthias Driess, Christian Monsé, Klaus Merz, Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2000

Language:

english

File:

PDF, 142 KB

english, 2000

19

Web Site: Spielerei verdeckt Nützliches

Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2003

Language:

german

File:

PDF, 56 KB

german, 2003

20

Stabilität von gasförmigem Thalliummonofluorid: TlF0, TlF+ und TlF2+

Detlef Schröder, Christoph van Wüllen, Helmut Schwarz, Thomas M. Klapötke

Journal:

Angewandte Chemie

Year:

2005

Language:

german

File:

PDF, 321 KB

german, 2005

21

Molecular Physics. Theoretical Principles and Experimental Methods. Von Wolfgang Demtröder.

Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2006

Language:

german

File:

PDF, 172 KB

german, 2006

22

Ein Heterofulven-analoges Germylen mit Betain-Reaktivität

Matthias Driess, Shenglai Yao, Markus Brym, Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2006

Language:

german

File:

PDF, 124 KB

german, 2006

23

Low-Valent Silicon Cations with Two-Coordinate Silicon and Aromatic Character

Matthias Driess, Shenglai Yao, Markus Brym, Christoph van Wüllen

Journal:

Angewandte Chemie

Year:

2006

Language:

english

File:

PDF, 110 KB

english, 2006

24

From a Stable Silylene to a Mixed-Valent Disiloxane and an Isolable Silaformamide–Borane Complex with Considerable Silicon–Oxygen Double-Bond Character

Shenglai Yao, Markus Brym, Christoph van Wüllen, Matthias Driess

Journal:

Angewandte Chemie

Year:

2007

Language:

english

File:

PDF, 114 KB

english, 2007

25

Das blaue Xe4+-Ion. Experimenteller Nachweis und theoretische Identifizierung

Stefan Seidel, Konrad Seppelt, Christoph van Wüllen, Xiao Ying Sun

Journal:

Angewandte Chemie

Year:

2007

Language:

german

File:

PDF, 106 KB

german, 2007

26

Dichotome Reaktivität eines stabilen Silylens gegenüber terminalen Alkinen: C-H-Insertion oder autokatalytische Bildung von Silacycloprop-3-en

Shenglai Yao, Christoph van Wüllen, Xiao-Ying Sun, Matthias Driess

Journal:

Angewandte Chemie

Year:

2008

Language:

german

File:

PDF, 344 KB

german, 2008

27

Handbook of Molecular Physics and Quantum Chemistry. Vols. 1–3. Edited by Stephen Wilson, Peter F. Bernath, and Roy McWeeny.

Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2003

Language:

english

File:

PDF, 56 KB

english, 2003

28

Web Site: A Playground with Hidden Treasures

Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2003

Language:

english

File:

PDF, 56 KB

english, 2003

29

Stability of Gaseous Thallium Monofluoride as TlF0, TlF+, and TlF2+

Detlef Schröder, Christoph van Wüllen, Helmut Schwarz, Thomas M. Klapötke

Journal:

Angewandte Chemie International Edition

Year:

2005

Language:

english

File:

PDF, 319 KB

english, 2005

30

Molecular Physics. Theoretical Principles and Experimental Methods. By Wolfgang Demtröder.

Christoph van Wüllen

Journal:

Angewandte Chemie International Edition

Year:

2006

Language:

english

File:

PDF, 172 KB

english, 2006

31

From a Stable Silylene to a Mixed-Valent Disiloxane and an Isolable Silaformamide–Borane Complex with Considerable Silicon–Oxygen Double-Bond Character

Shenglai Yao, Markus Brym, Christoph van Wüllen, Matthias Driess

Journal:

Angewandte Chemie International Edition

Year:

2007

Language:

english

File:

PDF, 115 KB

english, 2007

32

The Blue Xe4+ Cation: Experimental Detection and Theoretical Characterization

Stefan Seidel, Konrad Seppelt, Christoph van Wüllen, Xiao Ying Sun

Journal:

Angewandte Chemie International Edition

Year:

2007

Language:

english

File:

PDF, 104 KB

english, 2007

33

Dichotomic Reactivity of a Stable Silylene toward Terminal Alkynes: Facile CH Bond Insertion versus Autocatalytic Formation of Silacycloprop-3-ene

Shenglai Yao, Christoph van Wüllen, Xiao-Ying Sun, Matthias Driess

Journal:

Angewandte Chemie International Edition

Year:

2008

Language:

english

File:

PDF, 344 KB

english, 2008

34

Spin densities in two-component relativistic density functional calculations: Noncollinear versus collinear approach

Christoph Van Wüllen

Journal:

Journal of Computational Chemistry

Year:

2002

Language:

english

File:

PDF, 95 KB

english, 2002

35

Numerical instabilities in the computation of pseudopotential matrix elements

Christoph van Wüllen

Journal:

Journal of Computational Chemistry

Year:

2006

Language:

english

File:

PDF, 99 KB

english, 2006

36

A systematic quantum chemical investigation of the CH bond activation in methane by gas phase vanadium oxide cation VO+

Mikhail Pykavy, Christoph Van Wüllen

Journal:

Journal of Computational Chemistry

Year:

2007

Language:

english

File:

PDF, 140 KB

english, 2007

37

Shared-memory parallelization of the TURBOMOLE programs AOFORCE, ESCF, and EGRAD: How to quickly parallelize legacy code

Christoph van Wüllen

Journal:

Journal of Computational Chemistry

Year:

2011

Language:

english

File:

PDF, 114 KB

english, 2011

38

Ab initio calculation of magnetic properties by the “direct” IGLO method

Ulrich Meier, Christoph Van Wüllen, Michael Schindler

Journal:

Journal of Computational Chemistry

Year:

1992

Language:

english

File:

PDF, 807 KB

english, 1992

39

The MC-IGLO method

Christoph van Wüllen, Werner Kutzelnigg

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 757 KB

english, 1993

40

An implementation of a Kohn—Sham density functional program using a Gaussian-type basis set. Application to the equilibrium geometry of C60 and C70

Christoph van Wüllen

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 605 KB

english, 1994

41

A hybrid method for the evaluation of the matrix elements of the Coulomb potential

Christoph van Wüllen

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 377 KB

english, 1995

42

Computational evidence for a new C84 isomer

Michael Bühl, Christoph van Wüllen

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 434 KB

english, 1995

43

On the eigenfunctions of the Douglas–Kroll operator

Christoph van Wüllen

Journal:

Chemical Physics

Year:

2009

Language:

english

File:

PDF, 223 KB

english, 2009

44

Sixth-order Douglas–Kroll: two-component reference data for one-electron ions from through

Christoph van Wüllen

Journal:

Chemical Physics

Year:

2005

Language:

english

File:

PDF, 308 KB

english, 2005

45

Relativistic Effects in Heavy-Element Chemistry and Physics In Memoriam Bernd A. Heß (1954–2004)

Michael Dolg, Christoph van Wüllen

Journal:

Chemical Physics

Year:

2005

Language:

english

File:

PDF, 60 KB

english, 2005

46

Ab initio study of element 113–gold interactions

Andréi Zaitsevskii, Anatoly V. Titov, Alexander A. Rusakov, Christoph van Wüllen

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 219 KB

english, 2011

47

Computational studies on the copper(II) catalyzed Michael reaction

Julia Borowka, Christoph van Wüllen

Journal:

Journal of Organometallic Chemistry

Year:

2006

Language:

english

File:

PDF, 543 KB

english, 2006

48

Catalysis of the Michael reaction by iron(III): calculations, mechanistic insights and experimental consequences

Silke Pelzer, Thomas Kauf, Christoph van Wüllen, Jens Christoffers

Journal:

Journal of Organometallic Chemistry

Year:

2003

Language:

english

File:

PDF, 333 KB

english, 2003

49

Ligand Bridged Heterodinuclear Transition Metal Complexes – Syntheses, Structures and Electrochemical Investigations

Petra Escarpa Gaede, Christoph van Wüllen

Journal:

Zeitschrift für anorganische und allgemeine Chemie

Year:

2006

Language:

english

File:

PDF, 264 KB

english, 2006

50

Negative energy states in relativistic quantum chemistry

Christoph van Wüllen

Journal:

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

Year:

2012

Language:

english

File:

PDF, 255 KB

english, 2012

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