1. Advancing descriptor search in materials science: feature engineering and selection strategies. (1st November 2022) Authors: Hoock, Benedikt; Rigamonti, Santiago; Draxl, Claudia Journal: New journal of physics Issue: Volume 24:Number 11(2022) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. All-electron full-potential implementation of real-time TDDFT in exciting. (9th July 2021) Authors: Rodrigues Pela, Ronaldo; Draxl, Claudia Journal: Electronic structure Issue: Volume 3:Number 3(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. All-electron many-body approach to resonant inelastic X-ray scattering. Issue 29 (16th June 2022) Authors: Vorwerk, Christian; Sottile, Francesco; Draxl, Claudia Journal: Physical chemistry chemical physics Issue: Volume 24:Issue 29(2022) Page Start: 17439 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Bethe–Salpeter equation for absorption and scattering spectroscopy: implementation in the exciting code. (21st August 2019) Authors: Vorwerk, Christian; Aurich, Benjamin; Cocchi, Caterina; Draxl, Claudia Journal: Electronic structure Issue: Volume 1:Number 3(2019) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science. Issue 47 (21st October 2022) Authors: Teale, Andrew M.; Helgaker, Trygve; Savin, Andreas; Adamo, Carlo; Aradi, Bálint; Arbuznikov, Alexei V.; Ayers, Paul W.; Baerends, Evert Jan; Barone, Vincenzo; Calaminici, Patrizia; Cancès, Eric; Carter, Emily A.; Chattaraj, Pratim Kumar; Chermette, Henry; Ciofini, Ilaria; Crawford, T. Daniel; De ... Journal: Physical chemistry chemical physics Issue: Volume 24:Issue 47(2022) Page Start: 28700 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Ehrenfest dynamics implemented in the all-electron package exciting. (1st September 2022) Authors: Pela, Ronaldo Rodrigues; Draxl, Claudia Journal: Electronic structure Issue: Volume 4:Number 3(2022) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Electronic and Optical Excitations at the Pyridine/ZnO(101¯0) Hybrid Interface. Issue 2 (24th October 2018) Authors: Turkina, Olga; Nabok, Dmitrii; Gulans, Andris; Cocchi, Caterina; Draxl, Claudia Journal: Advanced theory and simulations Issue: Volume 2:Issue 2(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Electronic Structure of (Organic‐)Inorganic Metal Halide Perovskites: The Dilemma of Choosing the Right Functional. Issue 1 (17th December 2021) Authors: Vona, Cecilia; Nabok, Dmitrii; Draxl, Claudia Journal: Advanced theory and simulations Issue: Volume 5:Issue 1(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Graphene-modulated photo-absorption in adsorbed azobenzene monolayers. Issue 8 (13th February 2017) Authors: Fu, Qiang; Cocchi, Caterina; Nabok, Dmitrii; Gulans, Andris; Draxl, Claudia Journal: Physical chemistry chemical physics Issue: Volume 19:Issue 8(2017) Page Start: 6196 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Hybrid Materials: Electronic and Optical Excitations at the Pyridine/ZnO(101¯0) Hybrid Interface (Adv. Theory Simul. 2/2019). Issue 2 (4th February 2019) Authors: Turkina, Olga; Nabok, Dmitrii; Gulans, Andris; Cocchi, Caterina; Draxl, Claudia Journal: Advanced theory and simulations Issue: Volume 2:Issue 2(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗