Publications by authors named "Christopher Ehlert"

Claim this Profile
T
T-FINDER: A highly sensitive, pan-HLA platform for functional T cell receptor and ligand discovery.
Miray Cetin, Veronica Pinamonti, Theresa Schmid, Tamara Boschert, Ana Mellado Fuentes, Christopher Ehlert

Sci Adv· February 2024

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
CO on Graphene: Benchmarking Computational Approaches to Noncovalent Interactions.
Christopher Ehlert, Anna Piras, Ganna Gryn'ova

ACS Omega· October 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
M
Metal-Free Molecular Catalysts for the Oxygen Reduction Reaction: Electron Affinity as an Activity Descriptor.
Christopher Ehlert, Anna Piras, Juliette Schleicher, Ganna Gryn'ova

J Phys Chem Lett· January 2023

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
W
Why Ultrafast Photoinduced CO Desorption Dominates over Oxidation on Ru(0001).
Auguste Tetenoire, Christopher Ehlert, J I Juaristi, Peter Saalfrank, M Alducin

J Phys Chem Lett· September 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Stereoinversion of tetrahedral p-block element hydrides.
Lukas M Sigmund, Christopher Ehlert, Ganna Gryn'ova, Lutz Greb

J Chem Phys· May 2022

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
D
Dioxygen Activation and Pyrrole α-Cleavage with Calix[4]pyrrolato Aluminates: Enzyme Model by Structural Constraint.
Lukas Maximilian Sigmund, Christopher Ehlert, Markus Enders, Jürgen Graf, Ganna Gryn'ova

Angew Chem Int Ed Engl· July 2021

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
P
PSIXAS: A Psi4 plugin for efficient simulations of X-ray absorption spectra based on the transition-potential and Δ-Kohn-Sham method.
Christopher Ehlert, Tillmann Klamroth

J Comput Chem· July 2020

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
I
Iron doped gold cluster nanomagnets: determination of barriers for demagnetization.
Christopher Ehlert, Ian P Hamilton

Nanoscale Adv· April 2019

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
A
An efficient first principles method for molecular pump-probe NEXAFS spectra: Application to thymine and azobenzene.
Christopher Ehlert, Markus Gühr, Peter Saalfrank

J Chem Phys· October 2018

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
Control of Oxidation and Spin State in a Single-Molecule Junction.
Benjamin W Heinrich, Christopher Ehlert, Nino Hatter, Lukas Braun, Christian Lotze

ACS Nano· April 2018

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
T
The quest for best suited references for configuration interaction singles calculations of core excited states.
Christopher Ehlert, Tillmann Klamroth

J Comput Chem· January 2017

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
S
Systematic Investigation into the Matsuda-Heck Reaction of α-Methylene Lactones: How Conformational Constraints Direct the β-H-Elimination Step.
Bernd Schmidt, Felix Wolf, Christopher Ehlert

J Org Chem· November 2016

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
A
A detailed assignment of NEXAFS resonances of imidazolium based ionic liquids.
Christopher Ehlert, Markus Holzweber, Andreas Lippitz, Wolfgang E S Unger, Peter Saalfrank

Phys Chem Chem Phys· March 2016

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis
C
C K-edge NEXAFS spectra of graphene with physical and chemical defects: a study based on density functional theory.
Christopher Ehlert, Wolfgang E S Unger, Peter Saalfrank

Phys Chem Chem Phys· July 2014

Social Media Activity not collected for this article yet.

Sign Up to Request Social Media Analysis