[ab 2010] [2000-2009] [1990-1999] [vor 1990]

Veröffentlichungen ab 2010

G. Jansen
Symmetry-adapted perturbation theory based on density functional theory for noncovalent interactions
WIREs Comput Mol Sci (2013) 127-144.
DOI: 10.1002/wcms.1164

R. Schäffer und G. Jansen
Single-determinant-based symmetry-adapted perturbation theory without single-exchange approximation
Molecular Physics 111 (2013) 2570-2584.
DOI: 10.1080/00268976.2013.827253

S. Schulz, A. Kuczkowski, D. Bläser, C. Wölper, G. Jansen und R. Haack
Solid-State Structures of Trialkylbismuthines BiR3 (R = Me, i-Pr)
Organometallics 32 (2013) 5445-5450.
DOI: 10.1021/om400730r

B. Lhys, D. Bläser, C. Wölper, S. Schulz, R. Haack und G. Jansen
Synthesis and Structure of Base-Stabilized Germanium(II) Diazide IPrGe(N-3)(2)
Inorg. Chem. 52 (2013) 7236-7241.
DOI: 10.1021/ic400866c

M. Böning, B. Stuhlmann, G. Engler, M. Busker, T. Häber, A. Tekin, G. Jansen und K. Kleinermanns
Towards a Spectroscopic and Theoretical Identification of the Isolated Building Blocks of the Benzene-Acetylene Cocrystal.
ChemPhysChem 14 (2013) 837–846.
DOI: 10.1002/cphc.201200701

B. Lhys, D. Bläser, C. Wölper, S. Schulz und G. Jansen
A Comparison of the Solid-State Structures of Halogen Azides XN₃ (X=Cl, Br, I).
Angew. Chem. Int. Ed. 51 (2012) 12859 –12863
DOI: 10.1002/anie.201206028

B. Lhys, D. Bläser, C. Wölper, R. Haack, G. Jansen und S. Schulz
Structural Characterization of Amidinatobismuth(III) Diazides
Eur. J. Inorg. Chem. 27 (2012) 4350 – 4355
DOI: 10.1002/ejic.201200699

B. Gutschank, S. Schulz, M. Marcinkowski, G. Jansen, H. Bandmann, D. Bläser und C. Wölper,
Synthesis, Structure, Tautomerism, and Reactivity of Methanetrisamidines
Angew. Chem. Int. Ed. 51 (2012) 10893–10897
DOI: 10.1002/anie.201205030

D. Kuchenbecker und G. Jansen
Intermolecular Interactions in Weak Donor–Acceptor Complexes from Symmetry-Adapted Perturbation and Coupled-Cluster Theory : Tetracyanoethylene–Benzene and Tetracyanoethylene–p-Xylene.
ChemPhysChem 13 (2012) 2769–2776
DOI: 10.1002/cphc.201200164

E. Sánchez-García und G. Jansen
Competition between H···π and H···O Interactions in Furan Heterodimers
J. Phys. Chem. A 116 (2012) 5689 – 5697
DOI: 10.1021/jp301710y

R. Schäffer und G. Jansen
Intermolecular exchange-induction energies without overlap expansion
Theor. Chem. Acc. 131 (2012) 1235
DOI: 10.1007/s00214-012-1235-6

T. Gould, G. Jansen, I.V. Tokatly und J.F. Dobson
Quantum continuum mechanics made simple
J. Chem. Phys. 136 (2012) 204115
DOI: 10.1063/1.4721269

B. Lyhs, D. Bläser, C. Wölper, S. Schulz und G. Jansen
First Structural Characterization of Neutral, Base-Stabilized Group 15-Pentaazides: Single Crystal X-ray Structures of dmap-As(N₃)₅ and dmap-Sb(N₃)₅
Inorg. Chem. 51 (2012) 5897-5902
DOI: 10.1021/ic300523k

B. Gutschank, S. Schulz, M. Marcinkowski, G. Jansen, H. Bandmann, D. Bläser und C. Wölper
Synthesis, Structure, Tautomerism, and Reactivity of Methanetrisamidines
Angew. Chem. Int. Ed. 51 (2012) 10893 – 10897
DOI: 10.1002/anie.201205030

B. Lyhs, D. Bläser, C. Wölper, S. Schulz und G. Jansen
Solid-State Structure of Bromine Azide.
Angew. Chem. Int. Ed. 51 (2012) 1970-1974
DOI: 10.1002/anie.201108092

C. Leforestier, A. Tekin, G. Jansen und M. Herman
First principle potential for the acetylene dimer and refinement by fitting to experiments
J. Chem. Phys. 135 (2011) 234306
DOI: 10.1063/1.3668283

B. Lyhs, G. Jansen, D. Bläser, C. Wölper und S. Schulz
Syntheses and Structural Characterization of Antimony Polyazides.
Chem. Eur. J. 17 (2011) 11394-11398
DOI: 10.1002/chem.201102224

J.G. Angyan, R.-F. Liu, J. Toulouse und G. Jansen
Correlation Energy Expressions from the Adiabatic-Connection Fluctuation-Dissipation Theorem Approach
J. Chem. Theory Comput. 7 (2011) 3116 – 3130
DOI: 10.1021/ct200501r

J. Toulouse, W.M. Zhu, A. Savin, G. Jansen und J.G. Angyan
Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions
J. Chem. Phys. 8 (2011) 084119
DOI: 10.1063/1.3626551

A. D. Boese, G. Jansen, M. Torheyden, S. Höfener und W. Klopper
Effects of counterpoise correction and basis set extrapolation on the MP2 geometries of hydrogen bonded dimers of ammonia, water, and hydrogen fluoride
Phys. Chem. Chem. Phys. 13 (2011) 1230 – 1238
DOI: 10.1039/c0cp01493a

S. Schulz, B. Lyhs, G. Jansen, D. Bläser und C. Wölper
Syntheses and Structures of Triazides of Heavy Group 15 Elements.
Chem. Comm. 47 (2011) 3401-3403
DOI: 10.1039/c1cc10237k

A. D. Boese, H. Forbert, M. Masia, A. Tekin, D. Marx und G. Jansen
Constructing simple yet accurate potentials for describing the solvation of HCl/water clusters in bulk helium and nanodroplets
Phys. Chem. Chem. Phys. 13 (2011) 14551 – 14565
DOI: 10.1039/c1cp20991d

G. Jansen, R.-F- Liu und J. G. Angyan
On the equivalence of ring-coupled cluster and adiabatic connection fluctuation-dissipation theorem random phase approximation correlation energy expressions
J. Chem. Phys. 133 (2010) 154106
DOI: 10.1063/1.3481575

G. Jansen, B. Kahlert, F.-G. Klärner, R. Boese und D. Bläser
Intramolecular Eletronic Interactions between Nonconjugated Arene and Quinone Chromophores
J. Am. Chem. Soc. 132 (2010) 8581 – 8592
DOI: 10.1021/ja910362j

D. Kuchenbecker, S. Harder und G. Jansen
Insight in Structures of Superbulky Metallocenes with the Cp^BIG Ligand: Theoretical Considerations of Decaphenyl Metallocenes.
Z. Anorg. Allg. Chem. 636 (2010) 2257–2261
DOI: 10.1002/zaac.201000192