| Excited-state electronic structure of molecules using many-body Green’s functions: Quasiparticles and electron–hole excitations with VOTCA-XTP G Tirimbò, V Sundaram, O Çaylak, W Scharpach, J Sijen, C Junghans, ... The Journal of Chemical Physics 152 (11), 2020 | 33 | 2020 |
| Development and Testing of an All-Atom Force Field for Diketopyrrolopyrrole Polymers with Conjugated Substituents V Sundaram, AV Lyulin, B Baumeier The Journal of Physical Chemistry B 124 (48), 11030-11039, 2020 | 11 | 2020 |
| Effect of B-site cation ordering on high temperature thermoelectric behavior of BaxSr2− xTiFeO6 double perovskites DS Gyan, V Sundram, A Dwivedi, S Bhowmick, T Maiti Journal of Physics: Condensed Matter 32 (23), 235401, 2020 | 6 | 2020 |
| Effect of Solvent Removal Rate and Annealing on the Interface Properties in a Blend of a Diketopyrrolopyrrole-Based Polymer with Fullerene V Sundaram, AV Lyulin, B Baumeier The Journal of Physical Chemistry B 126 (38), 7445-7453, 2022 | 4 | 2022 |
| Quantum–Quantum and Quantum–Quantum-Classical Schemes for Near-Gap Excitations with Projection-Based-Embedded GW-Bethe–Salpeter Equation V Sundaram, B Baumeier Journal of Chemical Theory and Computation 20 (13), 5451-5465, 2024 | 2 | 2024 |
| Embedded Many‐Body Green's Function Methods for Electronic Excitations in Complex Molecular Systems G Tirimbó, V Sundaram, B Baumeier Wiley Interdisciplinary Reviews: Computational Molecular Science 14 (6), e1734, 2024 | 1 | 2024 |
| VOTCA: multiscale frameworks for quantum and classical simulations in soft matter B Baumeier, J Wehner, N Renaud, FZ Ruiz, R Halver, P Madhikar, ... Journal of Open Source Software 9 (LA-UR-24-25313), 2024 | 1 | 2024 |
| Time-Dependent Density Functional Theory and Green’s Functions Methods with the Bethe–Salpeter Equation W Scharpach, Z Chen, V Sundaram, B Baumeier Comprehensive Computational Chemistry, First Edition: Volume 1-4, V4-84-V4-115, 2023 | 1 | 2023 |
| Embedded Many-Body Green's Function Methods for Complex Molecular Systems G Tirimbó, V Sundaram, B Baumeier | | 2024 |
| Excitons in Polymer-Fullerene Morphologies: Multiscale Modeling, Implementation and Application V Sundaram | | 2024 |
| Quantum-quantum and quantum-quantum-classical schemes with projection-based-embedded -Bethe--Salpeter Equation V Sundaram, B Baumeier | | 2024 |
| Electronic Excitations from GW-BSE in Large Molecular Systems via hybrid embeddings V Sundaram, R Gerritsen, B Baumeier APS March Meeting Abstracts 2022, M48. 009, 2022 | | 2022 |
| VOTCA and LAMMPS for electronic spectroscopy and transport B Baumeier, C Junghans, R Gerritsen, V Sundaram Los Alamos National Laboratory (LANL), Los Alamos, NM (United States), 2021 | | 2021 |
Björn BaumeierEindhoven University of Technologytue.nl의 이메일 확인됨