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Lars Goerigk

Showing results (41-50 of 57) with videos related to

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Physical Chemistry Chemical Physics : PCCP|February 14, 2013
Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with cautionLars Goerigk, Amir Karton, Jan M L Martin, et al.
RSC Advances|July 2, 2025
Spin-scaled double hybrids with long-range correction solve the TD-DFT overestimation problem in BODIPY dyes: benchmarking and experimental validationShebual Sebastian, Vaughan Riley, Binuki Wanniarachchi, et al.
The Journal of Physical Chemistry. A|August 4, 2009
Optimization and basis-set dependence of a restricted-open-shell form of B2-PLYP double-hybrid density functional theoryDavid C Graham, Ambili S Menon, Lars Goerigk, et al.
Physical Chemistry Chemical Physics : PCCP|November 8, 2017
A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactionsLars Goerigk, Andreas Hansen, Christoph Bauer, et al.
Inorganic Chemistry|January 6, 2025
Cobalt Complexes with Aminophenolate Ligands: Spin Crossover and Ligand VersatilityI Haseena Ismail, Marcus J Giansiracusa, Robert W Gable, et al.
Organic & Biomolecular Chemistry|November 25, 2017
Structure-reactivity correlations of the abnormal Beckmann reaction of dihydrolevoglucosenone oximeAmani Alhifthi, Benjamin L Harris, Lars Goerigk, et al.
Angewandte Chemie (International Ed. in English)|July 12, 2017
Highly Fluorescent Pyridinium Betaines for Light HarvestingJingjing Xu, Bolong Zhang, Marina Jansen, et al.
Physical Chemistry Chemical Physics : PCCP|June 3, 2015
Photoisomerization action spectroscopy: flicking the protonated merocyanine-spiropyran switch in the gas phasePeter B Markworth, Brian D Adamson, Neville J A Coughlan, et al.
Journal of the American Chemical Society|July 13, 2018
Visible-Light-Driven "On"/"Off" Photochromism of a Polyoxometalate Diarylethene Coordination ComplexJingjing Xu, Henrieta Volfova, Roger J Mulder, et al.
Chemical Science|April 19, 2024
Predicting valence tautomerism in diverse cobalt-dioxolene complexes: elucidation of the role of ligands and solventF Zahra M Zahir, Moya A Hay, Jett T Janetzki, et al.
Pageof 6

Showing results (41-50 of 57) with videos related to

Sort By:
Pageof 6
Physical Chemistry Chemical Physics : PCCP|February 14, 2013
Accurate quantum chemical energies for tetrapeptide conformations: why MP2 data with an insufficient basis set should be handled with cautionLars Goerigk, Amir Karton, Jan M L Martin, et al.
RSC Advances|July 2, 2025
Spin-scaled double hybrids with long-range correction solve the TD-DFT overestimation problem in BODIPY dyes: benchmarking and experimental validationShebual Sebastian, Vaughan Riley, Binuki Wanniarachchi, et al.
The Journal of Physical Chemistry. A|August 4, 2009
Optimization and basis-set dependence of a restricted-open-shell form of B2-PLYP double-hybrid density functional theoryDavid C Graham, Ambili S Menon, Lars Goerigk, et al.
Physical Chemistry Chemical Physics : PCCP|November 8, 2017
A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactionsLars Goerigk, Andreas Hansen, Christoph Bauer, et al.
Inorganic Chemistry|January 6, 2025
Cobalt Complexes with Aminophenolate Ligands: Spin Crossover and Ligand VersatilityI Haseena Ismail, Marcus J Giansiracusa, Robert W Gable, et al.
Organic & Biomolecular Chemistry|November 25, 2017
Structure-reactivity correlations of the abnormal Beckmann reaction of dihydrolevoglucosenone oximeAmani Alhifthi, Benjamin L Harris, Lars Goerigk, et al.
Angewandte Chemie (International Ed. in English)|July 12, 2017
Highly Fluorescent Pyridinium Betaines for Light HarvestingJingjing Xu, Bolong Zhang, Marina Jansen, et al.
Physical Chemistry Chemical Physics : PCCP|June 3, 2015
Photoisomerization action spectroscopy: flicking the protonated merocyanine-spiropyran switch in the gas phasePeter B Markworth, Brian D Adamson, Neville J A Coughlan, et al.
Journal of the American Chemical Society|July 13, 2018
Visible-Light-Driven "On"/"Off" Photochromism of a Polyoxometalate Diarylethene Coordination ComplexJingjing Xu, Henrieta Volfova, Roger J Mulder, et al.
Chemical Science|April 19, 2024
Predicting valence tautomerism in diverse cobalt-dioxolene complexes: elucidation of the role of ligands and solventF Zahra M Zahir, Moya A Hay, Jett T Janetzki, et al.
Pageof 6