R. Laasner

ELSI - An open infrastructure for electronic structure solvers

Mathias Jacquelin, Yingzhou Li, Weile Jia, 2019, Comput. Phys. Commun..

Large-Scale Benchmark of Electronic Structure Solvers with the ELSI Infrastructure

Chao Yang, Mathias Jacquelin, Yingzhou Li, 2019 .

Long-Lived 13C2 Nuclear Spin States Hyperpolarized by Parahydrogen in Reversible Exchange at Microtesla Fields.

V. Blum, E. Chekmenev, T. Theis, 2017, The journal of physical chemistry letters.

Cation influence on exciton localization in homologue scheelites

A. Vasil’ev, M. Kirm, V. Sirutkaitis, 2015, Journal of physics. Condensed matter : an Institute of Physics journal.

ELSI - An open infrastructure for electronic structure solvers

Chao Yang, Yingzhou Li, Alberto García, 2019, Comput. Phys. Commun..

Density Functional Theory Study of Reaction Equilibria in Signal Amplification by Reversible Exchange.

S. Lehmkuhl, T. Theis, Patrick TomHon, 2021, Chemphyschem : a European journal of chemical physics and physical chemistry.

MatD^3^: A Database and Online Presentation Package for Research Data Supporting Materials Discovery, Design, and Dissemination

Volker Blum, Marco Govoni, Giulia Galli, 2019, J. Open Source Softw..

Rational ligand choice extends the SABRE substrate scope.

Steven J. Malcolmson, V. Blum, E. Chekmenev, 2020, Chemical communications.

G0W0 band structure of CdWO4

R. Laasner, 2014, Journal of physics. Condensed matter : an Institute of Physics journal.

Molecular NMR shieldings, J-couplings, and magnetizabilities from numeric atom-centered orbital based density-functional calculations

V. Blum, W. Huhn, T. Theis, 2018, 1805.12225.