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Prof. Dr. rer. nat. Georg Jansen

Fakultät für Chemie

Raum
S05 V07 E18
Telefon
+49(0)201/183-4421
Telefax
+49(0)201/183-4252
E-Mail
georg.jansen@uni-due.de
Webseite
http://www.uni-due.de/chemie/ak_jansen/

Funktionen

  • Universitätsprofessor/in, Theoretische Chemie

  • Gruppe der Professorinnen und Professoren, Fakultätsrat

  • Universitätsprofessor/in, Organische Chemie

Die folgenden Publikationen sind in der Online-Universitätsbibliographie der Universität Duisburg-Essen verzeichnet. Weitere Informationen finden Sie gegebenenfalls auch auf den persönlichen Webseiten der Person.

    Artikel in Zeitschriften

  • Scheller, Zoe Nonie; Miszewski, Noel; Brinkmann, Felix; Linders, Jürgen; Schaller, Torsten; Niemeyer, Felix; Wölper, Christoph; Jansen, Georg; Haberhauer, Gebhard
    Diaryl Telluroxides as Reversible Recognition Arrays in Solution
    In: Inorganic Chemistry, Jg. 64, 2025, Nr. 44, S. 22021 – 22029
    DOI
  • van der Vight, Felix; Schulz, Stephan; Jansen, Georg
    Effects of Dispersion and Charge-Transfer Interactions on Structures of Heavy Chalcogenide Compounds : A Quantum Chemical Case Study for (Et₂Bi)₂Te
    In: ChemPlusChem, Jg. 87, 2022, Nr. 4, e202100487
    DOI (Open Access)
  • Gehlhaar, Alexander; Wölper, Christoph; van der Vight, Felix; Jansen, Georg; Schulz, Stephan
    Noncovalent Intra- and Intermolecular Interactions in Peri-Substituted Pnicta Naphthalene and Acenaphthalene Complexes
    In: European Journal of Inorganic Chemistry, 2022, Nr. 2, e202100883
    DOI (Open Access)
  • Naglav-Hansen, Dominik; Dzialkowski, Kevin; Tobey, Briac; Wölper, Christoph; Jansen, Georg; Schulz, Stephan
    Hungry for charge : How a beryllium scorpionate complex "eats" a weakly coordinating anion
    In: Zeitschrift für Naturforschung B, Journal of Chemical Sciences, Jg. 75, 2020, Nr. 5, S. 503 – 508
    DOI
  • Gottschalk, Hannes C.; Poblotzki, Anja; Fatima, Mariyam; Obenchain, Daniel A.; Pérez, Cristóbal; Antony, Jens; Auer, Alexander A.; Baptista, Leonardo; Benoit, David M.; Bistoni, Giovanni; Bohle, Fabian; Dahmani, Rahma; Firaha, Dzmitry; Grimme, Stefan; Hansen, Andreas; Harding, Michael E.; Hochlaf, Majdi; Holzer, Christof; Jansen, Georg; Klopper, Wim; Kopp, Wassja A.; Krasowska, Małgorzata; Kröger, Leif C.; Leonhard, Kai; Mogren Al-Mogren, Muneerah; Mouhib, Halima; Neese, Frank; Pereira, Max N.; Prakash, Muthuramalingam; Ulusoy, Inga S.; Mata, Ricardo A.; Suhm, Martin A.; Schnell, Melanie
    The first microsolvation step for furans : New experiments and benchmarking strategies
    In: The Journal of Chemical Physics (JCP), Jg. 152, 2020, Nr. 16, S. 164303
    DOI (Open Access)
  • Saccone, Marco; Spengler, Matthias; Pfletscher, Michael; Kuntze, Kim; Virkki, Matti; Wölper, Christoph; Gehrke, Robert; Jansen, Georg; Metrangolo, Pierangelo; Priimagi, Arri; Giese, Michael R. A.
    Photoresponsive Halogen-Bonded Liquid Crystals : The Role of Aromatic Fluorine Substitution
    In: Chemistry of Materials, Jg. 31, 2019, Nr. 2, S. 462 – 470
    DOI, Online Volltext (Open Access)
  • Boese, A. Daniel; Jansen, Georg
    ZMP-SAPT : DFT-SAPT using ab initio densities
    In: The Journal of Chemical Physics (JCP), Jg. 150, 2019, Nr. 15
    DOI, Online Volltext (Open Access)
  • Podeszwa, Rafał; Jansen, Georg
    Comment on "Long-Range Repulsion Between Spatially Confined van der Waals Dimers"
    In: Physical Review Letters, Jg. 120, 2018, Nr. 25, S. 258901
    DOI
  • Haack, Rebekka; Schulz, Stephan; Jansen, Georg
    Dispersion interactions between neighboring Bi atoms in (BiH₃)₂ and Te(BiR₂)₂
    In: Journal of Computational Chemistry, Jg. 39, 2018, Nr. 20, S. 1413 – 1423
    DOI, Online Volltext (Open Access)
  • Hayduk, Matthias; Riebe, Steffen; Rudolph, Kevin; Schwarze, Sandrina; van der Vight, Felix; Daniliuc, Constantin G.; Jansen, Georg; Voskuhl, Jens
    Molecular Recognition of Spermine using Aggregation-Induced Emission
    In: Israel Journal of Chemistry, Jg. 58, 2018, Nr. 8, S. 927 – 931
    DOI
  • Naglav, Dominik; Tobey, Briac; Dzialkowski, Kevin; Bläser, Dieter; Wölper, Christoph; Jansen, Georg; Schulz, Stephan
    Solvent-induced ion separation of a beryllium scorpionate complex
    In: Dalton Transactions, Jg. 47, 2018, Nr. 36, S. 12511 – 12515
    DOI, Online Volltext (Open Access)
  • Jansen, Georg
    Spherical box model for London dispersion interactions
    In: Theoretical Chemistry Accounts, Jg. 137, 2018, Nr. 12, S. 171
    DOI
  • Octa-Smolin, Frescilia; Van Der Vight, Felix; Yadav, Rohan; Bhangu, Jasmine; Soloviova, Kateryna; Wölper, Christoph; Daniliuc, Constantin G.; Strassert, Cristian A.; Somnitz, Holger; Jansen, Georg; Niemeyer, Jochen
    Synthesis of Furan-Annelated BINOL Derivatives : Acid-Catalyzed Cyclization Induces Partial Racemization
    In: The Journal of Organic Chemistry, Jg. 83, 2018, Nr. 23, S. 14568 – 14587
    DOI
  • Gottschalk, Hannes C.; Poblotzki, Anja; Suhm, Martin A.; Al-Mogren, Muneerah M.; Antony, Jens; Auer, Alexander A.; Baptista, Leonardo; Benoit, David M.; Bistoni, Giovanni; Bohle, Fabian; Dahmani, Rahma; Firaha, Dzmitry; Grimme, Stefan; Hansen, Andreas; Harding, Michael E.; Hochlaf, Majdi; Holzer, Christof; Jansen, Georg; Klopper, Wim; Kopp, Wassja A.; Kröger, Leif C.; Leonhard, Kai; Mouhib, Halima; Neese, Frank; Pereira, Max N.; Ulusoy, Inga S.; Wuttke, Axel; Mata, Ricardo A.
    The furan microsolvation blind challenge for quantum chemical methods : first steps
    In: The Journal of Chemical Physics (JCP), Jg. 148, 2018, Nr. 1
    DOI (Open Access)
  • Riebe, Steffen; Vallet, Cecilia; van der Vight, Felix; Gonzalez-Abradelo, Dario; Wölper, Christoph; Strassert, Cristian A.; Jansen, Georg; Knauer, Shirley; Voskuhl, Jens
    Aromatic thioethers as novel luminophores with aggregation-induced fluorescence and phosphorescence
    In: Chemistry - A European Journal, Jg. 23, 2017, Nr. 55, S. 13660 – 13668
    DOI
  • Kuchenbecker, Dennis; Uhl, Felix; Forbert, Harald; Jansen, Georg; Marx, Dominik
    Constructing accurate interaction potentials to describe the microsolvation of protonated methane by helium atoms
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 19, 2017, Nr. 12, S. 8307 – 8321
    DOI
  • Wölper, Christoph; Jansen, Georg; Schulz, Stephan; Dzialkowski, Kevin; Tobey, Briac; Naglav, Dominik
    Insights into Molecular Beryllium–Silicon Bonds
    In: Inorganics, Jg. 5, 2017, Nr. 2, 22
    DOI, Online Volltext (Open Access)
  • Bernhard, Dominic; Dietrich, Fabian; Fatima, Mariyam; Perez, Cristobal; Poblotzki, Anja; Jansen, Georg; Suhm, Martin A.; Schnell, Melanie; Gerhards, Markus
    Multi-spectroscopic and theoretical analyses on the diphenyl ether–tert-butyl alcohol complex in the electronic ground and electronically excited state
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 19, 2017, Nr. 27, S. 18076 – 18088
    DOI (Open Access)
  • Bauer, Heiko; Orzechowski, Lars; Escalona, Ana; Jansen, Georg; Harder, Sjoerd
    Synthesis and Structure of a Dimeric Iminophosphorane Stabilized Zinc Carbene : (ZnCR₂)₂
    In: Organometallics, Jg. 36, 2017, Nr. 24, S. 4883 – 4890
    DOI
  • Naglav, Dominik; Tobey, Briac; Lyhs, Benjamin; Römer, Beate; Bläser, Dieter; Wölper, Christoph; Jansen, Georg; Schulz, Stephan
    Synthesis, Solid-State Structure, and Bonding Analysis of a Homoleptic Beryllium Azide
    In: Angewandte Chemie International Edition, Jg. 56, 2017, Nr. 29, Special Issue: 100th Anniversary of the Royal Australian Chemical Institute, S. 8559 – 8563
    DOI, Online Volltext (Open Access)
  • Ganesamoorthy, C.; Heimann, S.; Hölscher, S.; Haack, Rebekka; Wölper, Christoph; Jansen, Georg; Schulz, Stephan
    Synthesis, structure and dispersion interactions in bis(1,8-naphthalendiyl)distibine
    In: Dalton Transactions, Jg. 46, 2017, Nr. 28, S. 9227 – 9234
    DOI, Online Volltext (Open Access)
  • Stienen, Christian; Gondzik, Sebastian; Gehlhaar, Alexander; Haack, Rebekka; Wölper, Christoph; Jansen, Georg; Schulz, Stephan
    (MeZn)2(µ-ƞ2:ƞ2-N6Ph2) - A Powerful Starting Reagent for the Synthesis of Metal Hexazene Complexes
    In: Organometallics, Jg. 35, 2016, Nr. 7, S. 1022 – 1029
    DOI, Online Volltext (Open Access)
  • Mussard, Bastien; Rocca, Dario; Jansen, Georg; Ángyán, János G.
    Dielectric Matrix Formulation of Correlation Energies in the Random Phase Approximation : Inclusion of Exchange Effects
    In: Journal of Chemical Theory and Computation (JCTC), Jg. 12, 2016, Nr. 5, S. 2191 – 2202
    DOI, Online Volltext (Open Access)
  • Naglav, Dominik; Tobey, Briac; Wölper, Christoph; Bläser, Dieter; Jansen, Georg; Schulz, Stephan
    On the Stability of Trimeric Beryllium Hydroxide Scorpionate Complexes
    In: European Journal of Inorganic Chemistry, 2016, Nr. 15-16, S. 2424 – 2431
    DOI, Online Volltext (Open Access)
  • Lao, Ka Un; Schäffer, Rainer; Jansen, Georg; Herbert, John M.
    Accurate description of intermolecular interactions involving ions using symmetry-adapted perturbation theory
    In: Journal of Chemical Theory and Computation (JCTC), Jg. 11, 2015, Nr. 6, S. 2473 – 2486
    DOI
  • Naglav, Dominik; Neumann, Alexander; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
    Bonding situation in Be[N(SiMe3)2]2 : an experimental and computational study
    In: Chemical Communications: ChemComm, Jg. 51, 2015, Nr. 18, S. 3889 – 3891
    DOI, Online Volltext (Open Access)
  • Gondzik, Sebastian; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
    MeL2Zn2(μ-1,6-Ph2-N6) : a building block for new hexazene complexes
    In: Dalton Transactions, Jg. 44, 2015, S. 15703 – 15711
    DOI, Online Volltext (Open Access)
  • Hirschberg, Markus E.; Barthen, Peter; Frohn, Hermann-Josef; Bläser, Dieter; Tobey, Briac; Jansen, Georg
    Interaction of the electrophilic bis(pentafluorophenyl)iodonium cation [(C6F5)2I]+ with the ambident pseudohalogenide anions [SCN]− and [CN]−
    In: Journal of Fluorine Chemistry, Jg. 163, 2014, S. 28 – 33
    DOI
  • Jansen, Georg
    Molecules and wave functions : An introduction to quantum chemistry
    In: Chemie in unserer Zeit, Jg. 48, 2014, Nr. 3, S. 170 – 188
    DOI
  • Gondzik, Sebastian; Schulz, Stephan; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg
    Reactions of a Zn(I) complex with group 14 azides : formation of zinc azide and zinc hexazene complexes
    In: Chemical Communications: ChemComm, Jg. 50, 2014, Nr. 8, S. 927 – 929
    DOI, Online Volltext (Open Access)
  • Jansen, Georg
    Symmetry-adapted perturbation theory based on density functional theory for noncovalent interactions
    In: Wiley Interdisciplinary Reviews (WIREs): Computational Molecular Science, Jg. 4, 2014, Nr. 2, S. 127 – 144
    DOI
  • Heimann, Stefan; Kuczkowski, Andreas; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
    Syntheses an solid state structures of Et2SbTeEt and Et2BiTeEt
    In: European Journal of Inorganic Chemistry, Jg. 2014, 2014, Nr. 28, S. 4858 – 4864
    DOI, Online Volltext (Open Access)
  • Heimann, Stefan; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
    The bonding situation in triethylchalcogenostiboranes : polarized single bonds vs. double bonds
    In: Dalton Transactions, Jg. 43, 2014, S. 14772 – 14777
    DOI, Online Volltext (Open Access)
  • Schäffer, Rainer; Jansen, Georg
    Single-determinant-based symmetry-adapted perturbation theory without single-exchange approximation
    In: Molecular Physics (MPH), Jg. 111, 2013, Nr. 16-17, S. 2570 – 2584
    DOI
  • Schulz, Stephan; Kuczkowski, Andreas; Bläser, Dieter; Wölper, Christoph; Jansen, Georg; Haack, Rebekka
    Solid state structures of trialkylbismuthanes BiR3 (R = Me, i-Pr)
    In: Organometallics, Jg. 32, 2013, Nr. 19, S. 5445 – 5450
    DOI, Online Volltext (Open Access)
  • Lyhs, Benjamin; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan; Haack, Rebekka; Jansen, Georg
    Synthesis and structure of base-stabilized germanium(II) diazide IPrGe(N₃)₂
    In: Inorganic Chemistry, Jg. 52, 2013, Nr. 12, S. 7236 – 7241
    DOI, Online Volltext (Open Access)
  • Böning, Markus; Stuhlmann, Benjamin; Engler, Gernot; Busker, Matthias; Häber, Thomas; Tekin, Adem; Jansen, Georg; Kleinermanns, Karl
    Towards a spectroscopic and theoretical identification of the isolated building blocks of the benzene-acetylene cocrystal
    In: ChemPhysChem, Jg. 14, 2013, Nr. 4, S. 837 – 846
    DOI
  • Lyhs, Benjamin; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan; Jansen, Georg
    A Comparison of the Solid-State Structures of Halogen Azides XN₃ (X = Cl, Br, I)
    In: Angewandte Chemie International Edition, Jg. 51, 2012, Nr. 51, S. 12859 – 12863
    DOI, Online Volltext (Open Access)
  • Sánchez-García, Elsa; Jansen, Georg
    Competition between H···π and H···O interactions in furan heterodimers
    In: Journal of Physical Chemistry A: Molecules, Clusters, and Aerosols, Jg. 116, 2012, Nr. 23, S. 5689 – 5697
    DOI
  • Lyhs, Benjamin; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan; Jansen, Georg
    First Structural Characterization of Neutral, Base-Stabilized Group 15-Pentaazides - Single Crystal X-ray Structures of dmap-As(N3)5
    In: Inorganic Chemistry, Jg. 51, 2012, Nr. 10, S. 5897 – 5902
    DOI, Online Volltext (Open Access)
  • Schäffer, Rainer; Jansen, Georg
    Intermolecular exchange-induction energies without overlap expansion
    In: Theoretical Chemistry Accounts, Jg. 131, 2012, Nr. 6, S. 1235
    DOI
  • Kuchenbecker, Dennis; Jansen, Georg
    Intermolecular interactions in weak donor–acceptor complexes from symmetry-adapted perturbation and coupled-cluster theory : Tetracyanoethylene–Benzene and Tetracyanoethylene–p-Xylene
    In: ChemPhysChem, Jg. 13, 2012, Nr. 11, S. 2769 – 2776
    DOI
  • Gould, Tim; Jansen, Georg; Tokatly, I.V.; Dobson, John F.
    Quantum continuum mechanics made simple
    In: The Journal of Chemical Physics (JCP), Jg. 136, 2012, Art. Nr. 204115
    DOI
  • Lyhs, Benjamin; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan; Jansen, Georg
    Solid-State Structure of Bromine Azide
    In: Angewandte Chemie International Edition, Jg. 51, 2012, Nr. 8, S. 1970 – 1974
    DOI, Online Volltext (Open Access)
  • Lyhs, Benjamin; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
    Structural Characterization of Amidinatobismuth(III) Diazides
    In: European Journal of Inorganic Chemistry, Jg. 2012, 2012, Nr. 27, S. 4350 – 4355
    DOI, Online Volltext (Open Access)
  • Gutschank, Benjamin; Schulz, Stephan; Marcinkowski, Michael; Jansen, Georg; Bandmann, Heinz; Bläser, Dieter; Wölper, Christoph
    Synthesis, Structure, Tautomerism and Reactivity of Methanetrisamidines
    In: Angewandte Chemie International Edition, Jg. 51, 2012, Nr. 43, S. 10893 – 10897
    DOI, Online Volltext (Open Access)
  • Toulouse, Julien; Zhu, Wuming; Savin, Andreas; Jansen, Georg; Ángyán, János G.
    Closed-shell ring coupled cluster doubles theory with range separation applied on weak intermolecular interactions
    In: The Journal of Chemical Physics (JCP), Jg. 135, 2011, Nr. 8
    DOI
  • Daniel Boese, A.; Forbert, Harald; Masia, Marco; Tekin, Adem; Marx, Dominik; Jansen, Georg
    Constructing simple yet accurate potentials for describing the solvation of HCl/water clusters in bulk helium and nanodroplets
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 13, 2011, Nr. 32, S. 14550 – 14564
    DOI
  • Ángyán, János G.; Liu, Ru-Fen; Toulouse, Julien; Jansen, Georg
    Correlation energy expressions from the adiabatic-connection fluctuation-dissipation theorem approach
    In: Journal of Chemical Theory and Computation (JCTC), Jg. 7, 2011, Nr. 10, S. 3116 – 3130
    DOI
  • Boese, A. Daniel; Jansen, Georg; Torheyden, Martin; Höfener, Sebastian; Klopper, Wim
    Effects of counterpoise correction and basis set extrapolation on the MP2 geometries of hydrogen bonded dimers of ammonia, water, and hydrogen fluoride
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 13, 2011, Nr. 3, S. 1230 – 1238
    DOI
  • Leforestier, Claude; Tekin, Adem; Jansen, Georg; Herman, Michel
    First principles potential for the acetylene dimer and refinement by fitting to experiments
    In: The Journal of Chemical Physics (JCP), Jg. 135, 2011, Nr. 23, Art. Nr. 234306
    DOI
  • Schulz, Stephan; Lyhs, Benjamin; Jansen, Georg; Bläser, Dieter; Wölper, Christoph
    Syntheses and Structures of Triazides of Heavy Group 15 Elements
    In: Chemical Communications: ChemComm, Jg. 47, 2011, Nr. 12, S. 3401 – 3403
    DOI, Online Volltext (Open Access)
  • Lyhs, Benjamin; Jansen, Georg; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan
    Synthesis and Structural Characterization of Antimony Polyazides
    In: Chemistry - A European Journal, Jg. 17, 2011, Nr. 41, S. 11394 – 11398
    DOI, Online Volltext (Open Access)
  • Kuchenbecker, Dennis; Harder, Sjoerd; Jansen, Georg
    Insight in Structures of Superbulky Metallocenes with the CpBIG Ligand : Theoretical Considerations of Decaphenyl Metallocenes
    In: Zeitschrift für Anorganische und Allgemeine Chemie (ZAAC), Jg. 636, 2010, Nr. 12, S. 2257 – 2261
    DOI
  • Jansen, Georg; Bläser, Dieter; Boese, Roland; Klärner, Frank-Gerrit; Kahlert, Björn
    Intramolecular Electronic Interactions between Nonconjugated Arene and Quinone Chromophores
    In: Journal of the American Chemical Society: JACS, Jg. 132, 2010, Nr. 25, S. 8581 – 8592
    DOI
  • Jansen, Georg; Liu, Ru-Fen; Ángyán, János G.
    On the equivalence of ring-coupled cluster and adiabatic connection fluctuation-dissipation theorem random phase approximation correlation energy expressions
    In: The Journal of Chemical Physics (JCP), Jg. 133, 2010, Nr. 15, S. 154106
    DOI
  • Sánchez-García, Elsa; Mardyukov, Artur; Tekin, Adem; Crespo-Otero, Rachel; Montero, Luis A.; Sander, Wolfram; Jansen, Georg
    Ab initio and matrix isolation study of the acetylene-furan dimer
    In: Chemical Physics, Jg. 343, 2008, Nr. 2-3, S. 168 – 185
    DOI
  • Spielmann, Jan; Jansen, Georg; Bandmann, Heinz; Harder, Sjoerd
    Calcium amidoborane hydrogen storage materials : Crystal structures of decomposition products
    In: Angewandte Chemie International Edition, Jg. 47, 2008, Nr. 33, S. 6290 – 6295
    DOI
  • Fiethen, Annamaria; Jansen, Georg; Hesselmann, Andreas; Schütz, Martin
    Stacking energies for average B-DNA structures from the combined density functional theory and intermolecular perturbation theory approach
    In: Journal of the American Chemical Society: JACS, Jg. 130, 2008, Nr. 6, S. 1802 – 1803
  • Tekin, Adem; Jansen, Georg
    How accurate is the density functional theory combined with symmetry-adapted perturbation theory approach for CH-π and π-π interactions? : A comparison to supermolecular calculations for the acetylene-benzene dimer
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 9, 2007, Nr. 14, S. 1680 – 1687
    DOI
  • Sicking, Willi; Korth, Hans-Gert; Jansen, Georg; de Groot, Herbert; Sustmann, Reiner
    Hydrogen peroxide decomposition by a non-heme iron(III) catalase mimic : a DFT study
    In: Chemistry - A European Journal, Jg. 13, 2007, Nr. 15, S. 4230 – 4245
    DOI
  • Torheyden, Martin; Jansen, Georg
    A new potential energy surface for the water dimer obtained from separate fits of ab initio electrostatic, induction, dispersion and exchange energy contributions
    In: Molecular Physics (MPH), Jg. 104, 2006, Nr. 13-14, S. 2101 – 2138
    DOI
  • Weiss, Rainer; Jansen, Georg; Boese, Roland; Epple, Matthias
    Crystal structure and thermochemical reactivity of an unusual copper complex that contains copper in four different coordination geometries
    In: Dalton Transactions, 2006, Nr. 15, S. 1831 – 1835
    DOI
  • Hesselmann, Andreas; Jansen, Georg; Schütz, Martin
    Interaction energy contributions of Hydrogen-Bonded and Stacked Structures of the Adenine-Thymine and Guanine-Cytosine DNA Base Pairs from the combined Density Functional Theory and Intermolecular Perturbation Theory Approach
    In: Journal of the American Chemical Society: JACS, Jg. 128, 2006, S. 11730 – 11731
  • Orzechowski, Lars; Jansen, Georg; Harder, Sjoerd
    Synthesis, Structure, and Reactivity of a Stabilized Calcium Carbene : R2CCa
    In: Journal of the American Chemical Society: JACS, Jg. 128, 2006, Nr. 45, S. 14676 – 14684
    DOI
  • Heßelmann, Andreas; Jansen, Georg; Schütz, Martin
    Density-functional theory-symmetry-adapted intermolecular perturbation theory with density fitting : A new efficient method to study intermolecular interaction energies
    In: The Journal of Chemical Physics (JCP), Jg. 122, 2005, Nr. 1, S. 014103
    DOI
  • Vissers, Gé W.M.; Heßelmann, Andreas; Jansen, Georg; Wormer, Paul E.S.; Avoird, Ad van der
    New CO-CO interaction potential tested by rovibrational calculations
    In: The Journal of Chemical Physics (JCP), Jg. 122, 2005, Nr. 5, S. 054306
    DOI
  • Angyan, Janos G.; Chipot, Christophe; Dehez, Francois; Hattig, Christof; Jansen, Georg; Millot, Claude
    OPEP : A tool for the optimal partitioning of electric properties
    In: Journal of Computational Chemistry, Jg. 24, 2003, Nr. 8, S. 997 – 1008
    DOI
  • Hesselmann, Andreas; Jansen, Georg
    The helium dimer potential from a combined density functional theory and symmetry : adapted perturbation theory approach using an exact exchange-correlation potential
    In: Physical Chemistry, Chemical Physics (PCCP), Jg. 5, 2003, Nr. 22, S. 5010 – 5014
    DOI
  • Hesselmann, Andreas; Jansen, Georg
    First-order intermolecular interaction energies from Kohn-Sham orbitals
    In: Chemical Physics Letters, Jg. 357, 2002, Nr. 5-6, S. 464 – 470
    DOI
  • Hesselmann, Andreas; Jansen, Georg
    Intermolecular dispersion energies from time-dependent density functional theory
    In: Chemical Physics Letters, Jg. 367, 2002, Nr. 5-6, S. 778 – 784
    DOI
  • Hesselmann, Andreas; Jansen, Georg
    Intermolecular induction and exchange-induction energies from coupled-perturbed Kohn–Sham density functional theory
    In: Chemical Physics Letters, Jg. 362, 2002, Nr. 3-4, S. 319 – 325
    DOI
  • Raub, Stephan; Jansen, Georg
    A quantitative measure of bond polarity from the electron localization function and the theory of atoms in molecules
    In: Theoretical Chemistry Accounts, Jg. 106, 2001, Nr. 3, S. 223 – 232
    DOI
  • Jansen, Georg
    Convergence of multipole expanded intermolecular interaction energies for Gaussian-type-function and Slater-type-function basis sets
    In: Theoretical Chemistry Accounts, Jg. 104, 2000, Nr. 6, S. 499 – 506
    DOI
  • Hesselmann, Andreas; Jansen, Georg
    First-order intermolecular interaction energies from coupled-cluster Brueckner orbitals
    In: The Journal of Chemical Physics (JCP), Jg. 112, 2000, Nr. 16, S. 6949 – 6952
    DOI
  • Torheyden, Martin; Jansen, Georg
    Interaction energies for the water dimer by supermolecular methods and symmetry-adapted perturbation theory : the role of bond functions and convergence of basis subsets
    In: Theoretical Chemistry Accounts, Jg. 104, 2000, Nr. 5, S. 370 – 384
    DOI
  • Soetens, Jean-Christophe; Jansen, Georg; Millot, Claude
    Molecular dynamics simulation of liquid CCl4 with a new polarizable potential model
    In: Molecular Physics (MPH), Jg. 96, 1999, Nr. 7, S. 1003 – 1012
    DOI
  • Jansen, Georg; Schubart, Martin; Findeis, Bernd; Gade, Lutz H.; Scowen, Ian J.; McPartlin, Mary
    Unsupported Ti-Co and Zr-Co Bonds in Heterobimetallic Complexes : A Theoretical Description of Metal-Metal Bond Polarity
    In: Journal of the American Chemical Society: JACS, Jg. 120, 1998, Nr. 29, S. 7239 – 7251
    DOI
  • Soetens, Jean-Christophe; Millot, Claude; Chipot, Christophe; Jansen, Georg; Angyan, Janos G.; Maigret, Bernard
    Effect of Polarizability on the Potential of Mean Force of Two Cations : The Guanidinium−Guanidinium Ion Pair in Water
    In: Journal of Physical Chemistry B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical Chemistry, Jg. 101, 1997, Nr. 50, S. 10910 – 10917
    DOI
  • Jansen, Georg; Hattig, Christof; Hess, Bernd A.; Angyan, Janos G.
    Intermolecular interaction energies by topologically partitioned electric properties : 1. Electrostatic and induction energies in one-center and multicenter multipole expansions
    In: Molecular Physics (MPH), Jg. 88, 1996, Nr. 1, S. 69 – 92
    DOI
  • Jansen, Georg; Colonna, Francois; Angyan, Janos G.
    Mixed quantum-classical calculations on the water molecule in liquid phase : influence of a polarizable environment on electronic properties
    In: International Journal of Quantum Chemistry, Jg. 58, 1996, Nr. 3, S. 251 – 265
    DOI
  • Jansen, Georg
    The rovibrational spectrum of the ArCO complex calculated from a semiempirically extrapolated coupled pair functional potential energy surface.
    In: The Journal of Chemical Physics (JCP), Jg. 105, 1996, Nr. 1, S. 89 – 103
    DOI
  • Haettig, Christof; Jansen, Georg; Hess, Bernd A.; Angyan, Janos G.
    Topologically partitioned dynamic polarizabilities using the theory of atoms in molecules
    In: Canadian Journal of Chemistry, Jg. 74, 1996, Nr. 6, S. 976 – 987
    DOI
  • Jansen, Georg
    Coupled-pair functional calculations on the Ar-CO and Ar2 van der Waals complexes
    In: Chemical Physics Letters, Jg. 223, 1994, Nr. 4, S. 377 – 382
    DOI
  • Angyan, Janos G.; Jansen, Georg; Loos, Michel; Haettig, Christof; Hess, Bernd A.
    Distributed polarizabilities using the topological theory of atoms in molecules
    In: Chemical Physics Letters, Jg. 219, 1994, Nr. 3-4, S. 267 – 273
    DOI
  • Colonna, Francois; Jolly, Luc-Henri; Poirier, Raymond A.; Angyan, Janos G.; Jansen, Georg
    OSIPE : a tool for scientific programming in FORTRAN
    In: Computer Physics Communications, Jg. 81, 1994, Nr. 3, S. 293 – 317
    DOI
  • Jansen, Georg; Hess, Bernd A.; Marian, Christel M.; Angyan, Janos G.
    Ab initio determination of electronic energy splitting and transition rates for imidogen in argon matrixes
    In: The Journal of Physical Chemistry, Jg. 97, 1993, Nr. 39, S. 10011 – 10020
    DOI
  • Pizlo, Artur; Jansen, Georg; Hess, Bernd Artur; Von Niessen, Wolfgang
    Ionization potential and electron affinity of the gold atom and the gold hydride (AuH) molecule by all-electron, relativistic, configuration-interaction and propagator techniques
    In: The Journal of Chemical Physics (JCP), Jg. 98, 1993, Nr. 5, S. 3945 – 3951
    DOI
  • Blindauer, Carsten; Winter, Martin; Sild, Olev; Jansen, Georg; Hess, Bernd A.; Schurath, Ulrich
    Rotational-electronic splitting of matrix-isolated imidogen(NH/ND) a 1.DELTA. in argon cages of Oh and D3h symmetry : spectroscopic analysis and theoretical interpretation
    In: The Journal of Physical Chemistry, Jg. 97, 1993, Nr. 39, S. 10002 – 10010
    DOI
  • Jansen, Georg; Hess, Bernd A.; Wormer, Paul E. S.
    Theoretical investigation of the rovibrational fine-structure spectrum of argon-imidogen in its electronic ground state
    In: Chemical Physics Letters, Jg. 214, 1993, Nr. 1, S. 103 – 108
    DOI
  • Jansen, Georg; Hess, Bernd Artur
    Ab initio interaction potentials between an Ar atom and the NH radical in the states X 3Σ−, a 1Δ and b 1Σ+
    In: Chemical Physics Letters, Jg. 192, 1992, Nr. 1, S. 21 – 28
    DOI
  • Samzow, Reinhard; Hess, Bernd A.; Jansen, Georg
    Comment on : Relativistic linear combination of Gaussian‐type orbitals density functional method based on a two‐component formalism with external field projectors
    In: The Journal of Chemical Physics (JCP), Jg. 96, 1992, Nr. 8, S. 6320 – 6321
    DOI
  • Samzow, Reinhard; Hess, Bernd A.; Jansen, Georg
    The two‐electron terms of the no‐pair Hamiltonian
    In: The Journal of Chemical Physics (JCP), Jg. 96, 1992, Nr. 2, S. 1227 – 1231
    DOI
  • Jansen, Georg; Hess, Bernd A.
    Relativistic all-electron configuration interaction calculations on the gold atom
    In: Chemical Physics Letters, Jg. 160, 1989, Nr. 5-6, S. 507 – 513
    DOI

    • Beiträge in Sammelwerken und Tagungsbänden

  • Ángyán, János; Dobson, John; Jansen, Georg; Gould, Tim
    Introduction
    In: London Dispersion Forces in Molecules, Solids and Nano-structures: An Introduction to Physical Models and Computational Methods / Ángyán, Jánós G; Dobson, John; Jansen, Georg (Hrsg.). Cambridge: Royal Society of Chemistry, 2020, S. 1 – 434
    DOI
  • Jansen, Georg; Angyan, Janos G.; Colonna, Francois
    Solvent : A computer program for generalized self-consistent reaction field calculations
    In: Computational Chemistry: FECS Conference, Nancy, France, May 1994 / First European Conference on Computational Chemistry (ECCC 1) ; 23-27 May 1994, Nancy, France / Bernardi, Fernando; Rivail, Jean-Louis (Hrsg.). Woodbury: AIP, 1995, S. 44 – 51
    DOI

    • Bücher/Sammelwerke/Tagungsbände

  • Ángyán, János; Dobson, John; Jansen, Georg; Gould, Tim
    London Dispersion Forces in Molecules, Solids and Nano-structures : An Introduction to Physical Models and Computational Methods
    London: Royal Society of Chemistry (RSC), 2020
    (Theoretical and Computational Chemistry Series ; 16)
    DOI

    • Poster / Posterbeiträge

  • Weiss, Rainer; Jansen, Georg; Boese, Roland; Epple, Matthias
    Ein Cyanokomplex mit Kupfer in vier unterschiedlichen Koordinationsumgebungen
    13. Vortragstagung der Fachgruppe Festkörperchemie und Materialforschung, 20. bis 22. September 2006, Aachen, Germany,
    In: Zeitschrift für Anorganische und Allgemeine Chemie (ZAAC). Weinheim: Wiley-VCH, Jg. 632, 2006, Nr. 12-13, S. 2142
    DOI

    • Vorträge

  • Jansen, Georg
    Wenn sich Moleküle mögen
    Die kleine Form, 24. Mai 2006, Essen,
    2006(Die kleine Form 2006)
    Online Volltext, Online Volltext