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Journal Articles

TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations

Open Access
Sree Ganesh Balasubramani, Guo P. Chen, Sonia Coriani, Michael Diedenhofen, Marius S. Frank, Yannick J. Franzke, Filipp Furche, Robin Grotjahn, Michael E. Harding, Christof Hättig, Arnim Hellweg, Benjamin Helmich-Paris, Christof Holzer, Uwe Huniar, Martin Kaupp, Alireza Marefat Khah, Sarah Karbalaei Khani, Thomas Müller, Fabian Mack, Brian D. Nguyen, Shane M. Parker, Eva Perlt, Dmitrij Rappoport, Kevin Reiter, Saswata Roy, Matthias Rückert, Gunnar Schmitz, Marek Sierka, Enrico Tapavicza, David P. Tew, Christoph van Wüllen, Vamsee K. Voora, Florian Weigend, Artur Wodyński, Jason M. Yu
Journal: The Journal of Chemical Physics
J. Chem. Phys. 152, 184107 (2020)
https://doi.org/10.1063/5.0004635
Published: May 2020
View article titled, TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations
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Includes: Supplementary data
Journal Articles

The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry

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Hans Lischka, Ron Shepard, Thomas Müller, Péter G. Szalay, Russell M. Pitzer, Adelia J. A. Aquino, Mayzza M. Araújo do Nascimento, Mario Barbatti, Lachlan T. Belcher, Jean-Philippe Blaudeau, Itamar Borges, Jr., Scott R. Brozell, Emily A. Carter, Anita Das, Gergely Gidofalvi, Leticia González, William L. Hase, Gary Kedziora, Miklos Kertesz, Fábris Kossoski, Francisco B. C. Machado, Spiridoula Matsika, Silmar A. do Monte, Dana Nachtigallová, Reed Nieman, Markus Oppel, Carol A. Parish, Felix Plasser, Rene F. K. Spada, Eric A. Stahlberg, Elizete Ventura, David R. Yarkony, Zhiyong Zhang
Journal: The Journal of Chemical Physics
J. Chem. Phys. 152, 134110 (2020)
https://doi.org/10.1063/1.5144267
Published: April 2020
View article titled, The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry
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Journal Articles

3D microfluidics spray nozzle for sample processing and materials deposition

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Tadas Kartanas, Rui Rodrigues, Thomas Müller, Therese Herling, Tuomas Knowles, Jerome Charmet
Journal: AIP Conference Proceedings
AIP Conf. Proc. 2092, 020007 (2019)
https://doi.org/10.1063/1.5096675
Published: April 2019
View article titled, 3D microfluidics spray nozzle for sample processing and materials deposition
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Journal Articles

Influence of a supplemental filler in twin-screw extruded PP/CNT composites using masterbatch dilution

Free
Michael Thomas Müller, Beate Krause, Bernd Kretzschmar, Petra Pötschke
Journal: AIP Conference Proceedings
AIP Conf. Proc. 2055, 090006 (2019)
https://doi.org/10.1063/1.5084884
Published: January 2019
View article titled, Influence of a supplemental filler in twin-screw extruded PP/CNT composites using masterbatch dilution
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Journal Articles

Empirical exploration of timelike geodesics around a rotating wormhole

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Thomas Müller, Oliver Fechtig
Journal: American Journal of Physics
Am. J. Phys. 84, 375–383 (2016)
https://doi.org/10.1119/1.4943250
Published: May 2016
View article titled, Empirical exploration of timelike geodesics around a rotating wormhole
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Journal Articles

Perturbational treatment of spin-orbit coupling for generally applicable high-level multi-reference methods

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Sebastian Mai, Thomas Müller, Felix Plasser, Philipp Marquetand, Hans Lischka, Leticia González
Journal: The Journal of Chemical Physics
J. Chem. Phys. 141, 074105 (2014)
https://doi.org/10.1063/1.4892060
Published: August 2014
View article titled, Perturbational treatment of spin-orbit coupling for generally applicable high-level multi-reference methods
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Journal Articles

Scaling of the normal coefficient of restitution for wet impacts

Free
Thomas Müller, Frank Gollwitzer, Christof A. Krülle, Ingo Rehberg, Kai Huang
Journal: AIP Conference Proceedings
AIP Conf. Proc. 1542, 787–790 (2013)
https://doi.org/10.1063/1.4812049
Published: June 2013
View article titled, Scaling of the normal coefficient of restitution for wet impacts
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Journal Articles

Visualizing circular motion around a Schwarzschild black hole

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Thomas Müller, Sebastian Boblest
Journal: American Journal of Physics
Am. J. Phys. 79, 63–73 (2011)
https://doi.org/10.1119/1.3492722
Published: January 2011
View article titled, Visualizing circular motion around a Schwarzschild black hole
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Journal Articles

Distortion of the stellar sky by a Schwarzschild black hole

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Thomas Müller, Daniel Weiskopf
Journal: American Journal of Physics
Am. J. Phys. 78, 204–214 (2010)
https://doi.org/10.1119/1.3258282
Published: February 2010
View article titled, Distortion of the stellar sky by a Schwarzschild black hole
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Includes: Supplementary data
Journal Articles

MBE Growth of GaAs Whiskers on Si Nanowires

Free
Aaron Maxwell Andrews, Pavel Klang, Hermann Detz, Alois Lugstein, Matthias Schramböck, Mathias Steinmair, Youn‐Joo Hyun, Emmerich Bertagnolli, Thomas Müller, Karl Unterrainer, Werner Schrenk, Gottfried Strasser
Journal: AIP Conference Proceedings
AIP Conf. Proc. 1199, 261–262 (2010)
https://doi.org/10.1063/1.3295399
Published: January 2010
View article titled, MBE Growth of GaAs Whiskers on Si Nanowires
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Journal Articles

Ultrafast Spectroscopy As A Probe Of Light‐Matter Interaction In A Midinfrared Quantum Cascade Laser

Free
Wolfgang Parz, Thomas Müller, Juraj Darmo, Max Austerer, Gottfried Strasser, Luke R. Wilson, John W. Cockburn, Andrey B. Krysa, John S. Roberts, Karl Unterrainer
Journal: AIP Conference Proceedings
AIP Conf. Proc. 1199, 163–164 (2010)
https://doi.org/10.1063/1.3295347
Published: January 2010
View article titled, Ultrafast Spectroscopy As A Probe Of Light‐Matter Interaction In A Midinfrared Quantum Cascade Laser
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Journal Articles

Photoresponse enhancement in the near infrared wavelength range of ultrathin amorphous silicon photosensitive devices by integration of silver nanoparticles

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Etienne Moulin, Peiqing Luo, Bart Pieters, Joachim Sukmanowski, Joachim Kirchhoff, Wilfried Reetz, Thomas Müller, Reinhard Carius, Francois-Xavier Royer, Helmut Stiebig
Journal: Applied Physics Letters
Appl. Phys. Lett. 95, 033505 (2009)
https://doi.org/10.1063/1.3157264
Published: July 2009
View article titled, Photoresponse enhancement in the near infrared wavelength range of ultrathin amorphous silicon photosensitive devices by integration of silver nanoparticles
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Journal Articles

Ultrafast probing of light-matter interaction in a midinfrared quantum cascade laser

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Wolfgang Parz, Thomas Müller, Juraj Darmo, Karl Unterrainer, Max Austerer, Gottfried Strasser, Luke R. Wilson, John W. Cockburn, Andrey B. Krysa, John S. Roberts
Journal: Applied Physics Letters
Appl. Phys. Lett. 93, 091105 (2008)
https://doi.org/10.1063/1.2970046
Published: September 2008
View article titled, Ultrafast probing of light-matter interaction in a midinfrared quantum cascade laser
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Journal Articles

Precisely tunable continuous-wave terahertz source with interferometric frequency control

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Anselm J. Deninger, Thorsten Göbel, Daniel Schönherr, Thomas Kinder, Axel Roggenbuck, Markus Köberle, Frank Lison, Thomas Müller-Wirts, Peter Meissner
Journal: Review of Scientific Instruments
Rev. Sci. Instrum. 79, 044702 (2008)
https://doi.org/10.1063/1.2905033
Published: April 2008
View article titled, Precisely tunable continuous-wave terahertz source with interferometric frequency control
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Journal Articles

A trip to the end of the universe and the twin “paradox”

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Thomas Müller, Andreas King, Daria Adis
Journal: American Journal of Physics
Am. J. Phys. 76, 360–373 (2008)
https://doi.org/10.1119/1.2830528
Published: April 2008
View article titled, A trip to the end of the universe and the twin “paradox”
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Includes: Supplementary data
Journal Articles

On the ground and some low-lying excited states of ScB: A multiconfigurational study

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Ivan Černušák, Michal Dallos, Hans Lischka, Thomas Müller, Milan Uhlár
Journal: The Journal of Chemical Physics
J. Chem. Phys. 126, 214311 (2007)
https://doi.org/10.1063/1.2741522
Published: June 2007
View article titled, On the ground and some low-lying excited states of ScB: A multiconfigurational study
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Journal Articles

A Radio Frequency Quantum Point Contact Charge Read‐Out

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Thomas Müller, Kilian Vollenweider, Thomas Ihn, Roland Schleser, Martin Sigrist, Klaus Ensslin, Matthias Reinwald, Werner Wegscheider
Journal: AIP Conference Proceedings
AIP Conf. Proc. 893, 1113–1114 (2007)
https://doi.org/10.1063/1.2730287
Published: April 2007
View article titled, A Radio Frequency Quantum Point Contact Charge Read‐Out
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Journal Articles

Visual appearance of a Morris–Thorne-wormhole

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Thomas Müller
Journal: American Journal of Physics
Am. J. Phys. 72, 1045–1050 (2004)
https://doi.org/10.1119/1.1758220
Published: August 2004
View article titled, Visual appearance of a Morris–Thorne-wormhole
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Includes: Supplementary data
Journal Articles

An optical mounting system for cavity ring-down polarimetry

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Thomas Müller, Kenneth B. Wiberg, Patrick H. Vaccaro
Journal: Review of Scientific Instruments
Rev. Sci. Instrum. 73, 1340–1342 (2002)
https://doi.org/10.1063/1.1448906
Published: March 2002
View article titled, An optical mounting system for cavity ring-down polarimetry
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Journal Articles

Geometry optimization of excited valence states of formaldehyde using analytical multireference configuration interaction singles and doubles and multireference averaged quadratic coupled-cluster gradients, and the conical intersection formed by the 1  1 B 1 (σ-π * ) and 2  1 A 1 (π-π * ) states

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Michal Dallos, Thomas Müller, Hans Lischka, Ron Shepard
Journal: The Journal of Chemical Physics
J. Chem. Phys. 114, 746–757 (2001)
https://doi.org/10.1063/1.1331107
Published: January 2001
View article titled, Geometry optimization of excited valence states of formaldehyde using analytical multireference configuration interaction singles and doubles and multireference averaged quadratic coupled-cluster gradients, and the conical intersection formed by the 1  1 B 1 (σ-π * ) and 2  1 A 1 (π-π * ) states
Open the PDF for Geometry optimization of excited valence states of formaldehyde using analytical multireference configuration interaction singles and doubles and multireference averaged quadratic coupled-cluster gradients, and the conical intersection formed by the 1  1 B 1 (σ-π * ) and 2  1 A 1 (π-π * ) states in another window