Search Results - Herbst, Michael F.

Software for the frontiers of quantum chemistry: an overview of developments in the Q-Chem 5 package by Epifanovsky, Evgeny (Author) , Dempwolff, Adrian (Author) , Plasser, Felix (Author) , Rehn, Dirk R. (Author) , Herbst, Michael F. (Author) , Krauter, Caroline M. (Author) , Lefrancois, Daniel (Author) , Mewes, Jan-Michael (Author) , Mewes, Stefanie (Author) , Scheurer, Maximilian (Author) , Wenzel, Jan (Author) , Dreuw, Andreas (Author) ,

• Verlag, lizenzpflichtig, Volltext
• Verlag, lizenzpflichtig, Volltext

Quantum Chemistry Common Driver and Databases (QCDB) and Quantum Chemistry Engine (QCEngine): Automation and interoperability among computational chemistry programs by Smith, Daniel G. A. (Author) , Lolinco, Annabelle T. (Author) , Glick, Zachary L. (Author) , Lee, Jiyoung (Author) , Alenaizan, Asem (Author) , Barnes, Taylor A. (Author) , Borca, Carlos H. (Author) , Di Remigio, Roberto (Author) , Dotson, David L. (Author) , Ehlert, Sebastian (Author) , Heide, Alexander G. (Author) , Herbst, Michael F. (Author) , Hermann, Jan (Author) , Hicks, Colton B. (Author) , Horton, Joshua T. (Author) , Hurtado, Adrian G. (Author) , Kraus, Peter (Author) , Kruse, Holger (Author) , Lee, Sebastian J. R. (Author) , Misiewicz, Jonathon P. (Author) , Naden, Levi N. (Author) , Ramezanghorbani, Farhad (Author) , Scheurer, Maximilian (Author) , Schriber, Jeffrey B. (Author) , Simmonett, Andrew C. (Author) , Steinmetzer, Johannes (Author) , Wagner, Jeffrey R. (Author) , Ward, Logan (Author) , Welborn, Matthew (Author) , Altarawy, Doaa (Author) , Anwar, Jamshed (Author) , Chodera, John D. (Author) , Dreuw, Andreas (Author) , Kulik, Heather J. (Author) , Liu, Fang (Author) , Martínez, Todd J. (Author) , Matthews, Devin A. (Author) , Schaefer, Henry F. (Author) , Šponer, Jiří (Author) , Turney, Justin M. (Author) , Wang, Lee-Ping (Author) , De Silva, Nuwan (Author) , King, Rollin A. (Author) , Stanton, John F. (Author) , Gordon, Mark S. (Author) , Windus, Theresa L. (Author) , Sherrill, C. David (Author) , Burns, Lori A. (Author) ,

• Verlag, lizenzpflichtig, Volltext
• Verlag, lizenzpflichtig, Volltext

Gator: a Python-driven program for spectroscopy simulations using correlated wave functions by Rehn, Dirk R. (Author) , Rinkevicius, Zilvinas (Author) , Herbst, Michael F. (Author) , Li, Xin (Author) , Scheurer, Maximilian (Author) , Brand, Manuel (Author) , Dempwolff, Adrian (Author) , Brumboiu, Iulia E. (Author) , Fransson, Thomas (Author) , Dreuw, Andreas (Author) , Norman, Patrick (Author) ,

• Verlag, kostenfrei, Volltext
• Verlag, kostenfrei, Volltext

Quantifying the error of the core-valence separation approximation by Herbst, Michael F. (Author) , Fransson, Thomas (Author) ,

• Verlag, lizenzpflichtig, Volltext
• Verlag, lizenzpflichtig, Volltext

Quantum chemistry with Coulomb Sturmians: construction and convergence of Coulomb Sturmian basis sets at the Hartree-Fock level by Herbst, Michael F. (Author) , Avery, James Emil (Author) , Dreuw, Andreas (Author) ,

• Verlag, Volltext
• Verlag, Volltext

Development of a modular quantum-chemistry framework for the investigation of novel basis functions by Herbst, Michael F. (Author)

• Verlag, Inhaltsverzeichnis

Development of a modular quantum-chemistry framework for the investigation of novel basis functions by Herbst, Michael F. (Author)

• Resolving-System, kostenfrei, Volltext
• Resolving-System, kostenfrei, Volltext
• Resolving-System, Volltext
• Langzeitarchivierung Nationalbibliothek, Volltext
• Verlag, kostenfrei, Volltext
• Resolving-System, Unbekannt

Polarizable embedding combined with the algebraic diagrammatic construction: tackling excited states in biomolecular systems by Scheurer, Maximilian (Author) , Herbst, Michael F. (Author) , Dreuw, Andreas (Author) ,

• Verlag, Volltext

Toward quantum-chemical method development for arbitrary basis functions by Herbst, Michael F. (Author) , Dreuw, Andreas (Author) , Avery, James Emil (Author) ,

• Verlag, Volltext
• Verlag, Volltext