| CP2K: An electronic structure and molecular dynamics software package-Quickstep: Efficient and accurate electronic structure calculations TD Kühne, M Iannuzzi, M Del Ben, VV Rybkin, P Seewald, F Stein, ... The Journal of Chemical Physics 152 (19), 2020 | 1423 | 2020 |
| On the interaction of dihydrogen with aromatic systems O Hübner, A Glöss, M Fichtner, W Klopper The Journal of Physical Chemistry A 108 (15), 3019-3023, 2004 | 199 | 2004 |
| The structure of magnesium alanate M Fichtner, J Engel, O Fuhr, A Glöss, O Rubner, R Ahlrichs Inorganic chemistry 42 (22), 7060-7066, 2003 | 118 | 2003 |
| The MP2‐F12 method in the TURBOMOLE program package RA Bachorz, FA Bischoff, A Glöß, C Hättig, S Höfener, W Klopper, DP Tew Journal of Computational Chemistry 32 (11), 2492-2513, 2011 | 115 | 2011 |
| Slater-type geminals in explicitly-correlated perturbation theory: application to n-alkanols and analysis of errors and basis-set requirements S Höfener, FA Bischoff, A Glöß, W Klopper Physical Chemistry Chemical Physics 10 (23), 3390-3399, 2008 | 48 | 2008 |
| Explicitly correlated second-order perturbation theory calculations on molecules containing heavy main-group elements FA Bischoff, S Höfener, A Glöß, W Klopper Theoretical Chemistry Accounts 121 (1-2), 11-19, 2008 | 35 | 2008 |
| Accurate computational determination of the binding energy of the SO3∙ H2O complex H Fliegl, A Glöß, O Welz, M Olzmann, W Klopper The Journal of chemical physics 125 (5), 2006 | 33 | 2006 |
| Benchmarking different QM levels for usage with COSMO-RS J Reinisch, M Diedenhofen, R Wilcken, A Udvarhelyi, A Glöß Journal of Chemical Information and Modeling 59 (11), 4806-4813, 2019 | 24 | 2019 |
| Porting of the dbcsr library for sparse matrix-matrix multiplications to intel xeon phi systems I Bethune, A Glöss, J Hutter, A Lazzaro, H Pabst, F Reid Advances in Parallel Computing, Proceedings of the International Conference …, 2018 | 7 | 2018 |
| TURBOMOLE 6.6. A development of University of Karlsruhe and Forschungszentrum Karlsruhe GmbH, 1989–2007, TURBOMOLE GmbH, since 2007, Karlsruhe, Germany R Ahlrichs, MK Armbruster, RA Bachorz, M Bär, HP Baron, ... | 5 | 2014 |
| The MP2 binding energy of the ethene dimer and its dependence on the auxiliary basis sets: a benchmark study using a newly developed infrastructure for the processing of … A Glöß, MP Brändle, W Klopper, HP Lüthi Molecular Physics 110 (19-20), 2523-2534, 2012 | 5 | 2012 |
| The quantum chemical search for novel materials and the issue of data processing: The InfoMol project HP Lüthi, S Heinen, G Schneider, A Glöss, MP Brändle, RA King, ... Journal of Computational Science 15, 65-73, 2016 | 4 | 2016 |
| Entwicklung und Implementierung schneller MP2-R12 Methoden A Glöß | 3 | 2007 |
| DBCSR: A Sparse Matrix Multiplication Library for Electronic Structure Codes A Glöss, A Lazzaro, P Seewald, O Schütt, H Pabst, J Hutter | | |
| DBCSR: A Library for Sparse Matrix Multiplications A Glöß, A Lazzaro, T Müller, P Seewald, I Sivkov, J Hutter | | |
