1. A black-box, general purpose quadratic self-consistent field code with and without Cholesky decomposition of the two-electron integrals. (17th November 2021) Authors: Nottoli, Tommaso; Gauss, Jürgen; Lipparini, Filippo Journal: Molecular physics Issue: Volume 119:Number 21/22(2021) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A polarisable QM/MM description of NMR chemical shifts of a photoreceptor protein. (17th October 2020) Authors: Hashem, Shaima; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta Journal: Molecular physics Issue: Volume 118:Number 19/20(2020) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Cover Feature: Electronic Circular Dichroism Imaging (ECDi) Casts a New Light on the Origin of Solid‐State Chiroptical Properties (Chem. Eur. J. 4/2022). Issue 4 (3rd January 2022) Authors: Górecki, Marcin; Lipparini, Filippo; Albano, Gianluigi; Jávorfi, Tamás; Hussain, Rohanah; Siligardi, Giuliano; Pescitelli, Gennaro; Di Bari, Lorenzo Journal: Chemistry Issue: Volume 28:Issue 4(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Electronic Circular Dichroism Imaging (ECDi) Casts a New Light on the Origin of Solid‐State Chiroptical Properties. Issue 4 (21st December 2021) Authors: Górecki, Marcin; Lipparini, Filippo; Albano, Gianluigi; Jávorfi, Tamás; Hussain, Rohanah; Siligardi, Giuliano; Pescitelli, Gennaro; Di Bari, Lorenzo Journal: Chemistry Issue: Volume 28:Issue 4(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Elucidating the role of structural fluctuations, and intermolecular and vibronic interactions in the spectroscopic response of a bacteriophytochrome. Issue 16 (7th April 2020) Authors: Macaluso, Veronica; Cupellini, Lorenzo; Salvadori, Giacomo; Lipparini, Filippo; Mennucci, Benedetta Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 16(2020) Page Start: 8585 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Excited state Born–Oppenheimer molecular dynamics through coupling between time dependent DFT and AMOEBA. Issue 35 (26th August 2020) Authors: Nottoli, Michele; Mennucci, Benedetta; Lipparini, Filippo Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 35(2020) Page Start: 19532 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. From crystallographic data to the solution structure of photoreceptors: the case of the AppA BLUF domain. Issue 40 (17th September 2021) Authors: Hashem, Shaima; Macaluso, Veronica; Nottoli, Michele; Lipparini, Filippo; Cupellini, Lorenzo; Mennucci, Benedetta Journal: Chemical science Issue: Volume 12:Issue 40(2021) Page Start: 13331 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. How to make continuum solvation incredibly fast in a few simple steps: A practical guide to the domain decomposition paradigm for the conductor‐like screening model. Issue 1 (31st August 2018) Authors: Stamm, Benjamin; Lagardère, Louis; Scalmani, Giovanni; Gatto, Paolo; Cancès, Eric; Piquemal, Jean‐Philip; Maday, Yvon; Mennucci, Benedetta; Lipparini, Filippo Other Names: Andreussi Oliviero guestEditor.; Frediani Luca guestEditor.; Kulik Heather J. guestEditor. Journal: International journal of quantum chemistry Issue: Volume 119:Issue 1(2019) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. LICHEM: A QM/MM program for simulations with multipolar and polarizable force fields. Issue 11 (18th January 2016) Authors: Kratz, Eric G.; Walker, Alice R.; Lagardère, Louis; Lipparini, Filippo; Piquemal, Jean‐Philip; Andrés Cisneros, G. Journal: Journal of computational chemistry Issue: Volume 37:Issue 11(2016) Page Start: 1019 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Polarizable embedding QM/MM: the future gold standard for complex (bio)systems?. Issue 26 (26th June 2020) Authors: Bondanza, Mattia; Nottoli, Michele; Cupellini, Lorenzo; Lipparini, Filippo; Mennucci, Benedetta Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 26(2020) Page Start: 14433 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗