Publikationsliste einschränken

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 bis  

• englisch (22)
• deutsch (2)

• Dreuw, Andreas (20)
• Plasser, Felix (6)
• Wenzel, Jan (6)
• Mewes, Stefanie (4)
• Rehn, Dirk R. (4)
• Harbach, Philipp H. P. (3)
• Krauter, Caroline M. (2)

• Kriesche, Thomas (1)
• Lefrancois, Daniel (1)
• Holzer, Andre (1)
• Gromov, Evgeniy (1)
• Thomitzni, Benjamin (1)
• Schneider, Matthias (1)

• Calvo, Florent (2)
• Mewes, Jan-Michael (1)
• Knippenberg, Stefan (1)
• Shao, Yihan (1)
• Epifanovsky, Evgeny (1)
• Holland, David M.P. (1)
• Schwerdtfeger, Peter (1)

• Saue, Trond (1)
• Olejniczak, Małgorzata (1)
• Deppenmeier, Anna-Lena (1)
• Borschevsky, Anastasia (1)
• Head-Gordon, Martin (1)
• Wiebke, Jonas (1)
• Schwerdtfeger, P. (1)
• Pahl, E. (1)
• Hellmann, R. (1)
• Plötner, Jürgen (1)
• Dutoi, Anthony Dean (1)

Publikationen in heiBIB     

• Shao, Yihan: Advances in molecular quantum chemistry contained in the Q-Chem 4 program package / Yihan Shao, Zhengting Gan, Evgeny Epifanovsky, Andrew T.B. Gilbert, Michael Wormit, Joerg Kussmann, … , 2015. - 32 S.
  In: Molecular physics, ISSN 1362-3028. 113(2015), 2, Seite 184-215
  DOI: 10.1080/00268976.2014.952696
• Plasser, Felix: Statistical analysis of electronic excitation processes : spatial location, compactness, charge transfer, and electron-hole correlation / Felix Plasser, Benjamin Thomitzni, Stefanie A. Bäppler, Jan Wenzel, Dirk R. Rehn, Michael Wormit, an… , 29 June 2015. - 12 S.
  In: Journal of computational chemistry, ISSN 1096-987X. 36(2015), 21, Seite 1609-1620
  DOI: 10.1002/jcc.23975
• Holland, David M.P.: A study of the excited electronic states of normal and fully deuterated furan by photoabsorption spectroscopy and high-level ab initio calculations / D.M.P. Holland, E.A. Seddon, A.B. Trofimov, E.V. Gromov, M. Wormit, A. Dreuw, T. Korona, N. de Olive… . - 12 S.
  In: Journal of molecular spectroscopy, ISSN 0022-2852. 315(2015), Supplement C, S. 184-195
  DOI: 10.1016/j.jms.2015.03.002
• Dreuw, Andreas: The algebraic diagrammatic construction scheme for the polarization propagator for the calculation of excited states / Andreas Dreuw and Michael Wormit. - 14 S.
  In: Wiley interdisciplinary reviews, ISSN 1759-0884. 5(2015), 1, S. 82-95
  DOI: 10.1002/wcms.1206
• Mewes, Jan-Michael: Experimental benchmark data and systematic evaluation of two a posteriori, polarizable-continuum corrections for vertical excitation energies in solution / Jan-Michael Mewes, Zhi-Qiang You, Michael Wormit, Thomas Kriesche, John M. Herbert, Andreas Dreuw, January 28, 2015. - 19 S.
  In: The journal of physical chemistry, ISSN 1520-5215. 119(2015), 21, Seite 5446-5464
  DOI: 10.1021/jp511163y
• Schneider, Matthias: A fresh look at the photoelectron spectrum of bromobenzene : a third-order non-Dyson electron propagator study / M. Schneider, D. Yu. Soshnikov, D.M.P. Holland, I. Powis, E. Antonsson, M. Patanen, C. Nicolas, C. M… , 9 October 2015. - 12 S.
  In: The journal of chemical physics, ISSN 1089-7690. 143(2015,14) Artikelnummer 144103, 12 Seiten
  DOI: 10.1063/1.4931643
• Wenzel, Jan: Analysis and comparison of CVS-ADC approaches up to third order for the calculation of core-excited states / Jan Wenzel, Andre Holzer, Michael Wormit, Andreas Dreuw
  In: The journal of chemical physics, ISSN 1089-7690. 142(2015,21) Artikelnummer 214104, 18 Seiten
  DOI: 10.1063/1.4921841
• Lefrancois, Daniel: Adapting algebraic diagrammatic construction schemes for the polarization propagator to problems with multi-reference electronic ground states exploiting the spin-flip ansatz / Daniel Lefrancois, Michael Wormit, and Andreas Dreuw, 28 September 2015. - 10 S.
  In: The journal of chemical physics, ISSN 1089-7690. 143(2015,12) Artikelnummer 124107, 10 Seiten
  DOI: 10.1063/1.4931653
• Wiebke, Jonas: Can an ab initio three-body virial equation describe the mercury gas phase? / J. Wiebke, M. Wormit, R. Hellmann, E. Pahl, and P. Schwerdtfeger, February 18, 2014. - 9 S.
  In: The journal of physical chemistry, ISSN 1520-5207. 118(2014), 12, Seite 3392-3400
  DOI: 10.1021/jp412260a
• Wormit, Michael: Strong enhancement of parity violation effects in chiral uranium compounds / Michael Wormit, Małgorzata Olejniczak, Anna-Lena Deppenmeier, Anastasia Borschevsky, Trond Saue and … , 27 June 2014. - 9 S.
  In: Physical chemistry, chemical physics, ISSN 1463-9084. 16(2014), 32, Seite 17043-17051
  DOI: 10.1039/C4CP01904K
• Mewes, Stefanie: Exciton analysis of many-body wave functions : bridging the gap between the quasiparticle and molecular orbital pictures / Stefanie A. Bäppler, Felix Plasser, Michael Wormit, and Andreas Dreuw, 26 November 2014. - 12 S.
  In: Physical review, ISSN 1094-1622. 90(2014,5) Artikelnummer 052521, 12 Seiten
  DOI: 10.1103/PhysRevA.90.052521
• Harbach, Philipp H. P.: The third-order algebraic diagrammatic construction method (ADC(3)) for the polarization propagator for closed-shell molecules : efficient implementation and benchmarking / Philipp H.P. Harbach, Michael Wormit, and Andreas Dreuw, 13 August 2014. - 17 S.
  In: The journal of chemical physics, ISSN 1089-7690. 141(2014,17) Artikelnummer 064113, 17 Seiten
  DOI: 10.1063/1.4892418
• Wormit, Michael: Investigating excited electronic states using the algebraic diagrammatic construction (ADC) approach of the polarisation propagator / Michael Wormit, Dirk R. Rehn, Philipp H.P. Harbach, Jan Wenzel, Caroline M. Krauter, Evgeny Epifanov… , 04 Mar 2014. - 11 S.
  In: Molecular physics, ISSN 1362-3028. 112(2014), 5-6, Seite 774-784
  DOI: 10.1080/00268976.2013.859313
• Wenzel, Jan: Calculating X-ray absorption spectra of open-shell molecules with the unrestricted algebraic-diagrammatic construction scheme for the polarization propagator / Jan Wenzel, Michael Wormit, and Andreas Dreuw. - 16 S.
  In: Journal of chemical theory and computation, ISSN 1549-9626. 10(2014), 10, S. 4583-4598
  DOI: 10.1021/ct5006888
• Wenzel, Jan: Calculating core-level excitations and x-ray absorption spectra of medium-sized closed-shell molecules with the algebraic-diagrammatic construction scheme for the polarization propagator / Jan Wenzel, Michael Wormit, and Andreas Dreuw. - 16 S.
  In: Journal of computational chemistry, ISSN 1096-987X. 35(2014), 26, S. 1900-1915
  DOI: 10.1002/jcc.23703
• Plasser, Felix: New tools for the systematic analysis and visualization of electronic excitations : II. Applications / Felix Plasser, Stefanie A. Bäppler, Michael Wormit, and Andreas Dreuw
  In: The journal of chemical physics, ISSN 1089-7690. 141(2014,2) Artikelnummer 024107, 12 Seiten
  DOI: 10.1063/1.4885820
• Plasser, Felix: New tools for the systematic analysis and visualization of electronic excitations : I. Formalism / Felix Plasser, Michael Wormit, and Andreas Dreuw
  In: The journal of chemical physics, ISSN 1089-7690. 141(2014,13) Artikelnummer 024106, 13 Seiten
  DOI: 10.1063/1.4885819
• Plasser, Felix: New tools for the systematic analysis and visualization of electronic excitations : II. Applications / F. Plasser, S. A. Bäppler, M. Wormit, A. Dreuw. - 12 S.
  In: The journal of chemical physics, ISSN 0021-9606. 141(2014), S. 024107/1-024107/12
• Plasser, Felix: New tools for the systematic analysis and visualization of electronic excitations : I. Formalism / F. Plasser, M. Wormit, A. Dreuw. - 13 S.
  In: The journal of chemical physics, ISSN 0021-9606. 141(2014), S. 024106/1-024106/13
• Epifanovsky, Evgeny: New implementation of high-level correlated methods using a general block tensor library for high-performance electronic structure calculations / Evgeny Epifanovsky, Michael Wormit, Tomasz Kuś, Arie Landau, Dmitry Zuev, Kirill Khistyaev, Prashant… . - 17 S.
  In: Journal of computational chemistry, ISSN 1096-987X. 34(2013), 26, S. 2293-2309
  DOI: 10.1002/jcc.23377
• Calvo, Florent: Erklärung des niedrigen Schmelzpunkts von Quecksilber mit relativistischen Effekten / F. Calvo ; E. Pah ; M. Wormit ; P. Schwerdtfeger. - 4 S.
  In: Angewandte Chemie, ISSN 1521-3757. 125(2013), 29, S. 7731-7734
  DOI: 10.1002/ange.201302742
• Calvo, Florent: Evidence for low-temperature melting of mercury owing to relativity / F. Calvo ; E. Pahl ; M. Wormit ; P. Schwerdtfeger. - 3 S.
  In: Angewandte Chemie, ISSN 1521-3773. 52(2013), 29, S. 7583-7585
  DOI: 10.1002/anie.201302742
• Knippenberg, Stefan: Calculations of nonlinear response properties using the intermediate state representation and the algebraic-diagrammatic construction polarization propagator approach : two-photon absorption spectra / S. Knippenberg, D.R. Rehn, M. Wormit, J.H. Starcke, I.L. Rusakova, A.B. Trofimov, and A. Dreuw
  In: The journal of chemical physics, ISSN 1089-7690. 136(2012,15) Artikelnummer 064107, 15 Seiten
  DOI: 10.1063/1.3682324
• Dreuw, Andreas: An additive long-range potential to correct for the charge-transfer failure of time-dependent density functional theory / Andreas Dreuw, Jürgen Plötner, Michael Wormit, Martin Head-Gordon, Anthony Dean Dutoi, 10. Mai 2010. - 14 S.
  In: Zeitschrift für physikalische Chemie, ISSN 2196-7156. 224(2010), 3/4, Seite 311-324
  DOI: 10.1524/zpch.2010.6107

IDs

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139246460

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