1. An experimental and theoretical study of an efficient polymer nano-photocatalyst for hydrogen evolution. Issue 6 (26th May 2017) Authors: Pati, Palas Baran; Damas, Giane; Tian, Lei; Fernandes, Daniel L. A.; Zhang, Lei; Pehlivan, Ilknur Bayrak; Edvinsson, Tomas; Araujo, C. Moyses; Tian, Haining Journal: Energy & environmental science Issue: Volume 10:Issue 6(2017) Page Start: 1372 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Assessing structure and stability of polymer/lithium-metal interfaces from first-principles calculations. Issue 14 (19th March 2019) Authors: Ebadi, Mahsa; Marchiori, Cleber; Mindemark, Jonas; Brandell, Daniel; Araujo, C. Moyses Journal: Journal of materials chemistry Issue: Volume 7:Issue 14(2019) Page Start: 8394 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Assessing the electrochemical properties of polypyridine and polythiophene for prospective applications in sustainable organic batteries. Issue 4 (16th January 2017) Authors: Araujo, Rafael B.; Banerjee, Amitava; Panigrahi, Puspamitra; Yang, Li; Sjödin, Martin; Strømme, Maria; Araujo, C. Moyses; Ahuja, Rajeev Journal: Physical chemistry chemical physics Issue: Volume 19:Issue 4(2017) Page Start: 3307 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Carbon dioxide reduction mechanism on Ru-based electrocatalysts [Ru(bpy)2(CO)2]2+: insights from first-principles theory. Issue 23 (3rd November 2021) Authors: Damas, Giane B.; Ivashchenko, Dmytro A.; Rivalta, Ivan; Araujo, C. Moyses Journal: Sustainable energy & fuels Issue: Volume 5:Issue 23(2021) Page Start: 6066 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Designing strategies to tune reduction potential of organic molecules for sustainable high capacity battery application. Issue 9 (6th February 2017) Authors: Araujo, Rafael B.; Banerjee, Amitava; Panigrahi, Puspamitra; Yang, Li; Strømme, Maria; Sjödin, Martin; Araujo, C. Moyses; Ahuja, Rajeev Journal: Journal of materials chemistry Issue: Volume 5:Issue 9(2017) Page Start: 4430 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Dimension-dependent band alignment and excitonic effects in graphitic carbon nitride: a many-body perturbation and time-dependent density functional theory study. Issue 71 (20th September 2017) Authors: Espinosa-García, W. F.; Osorio-Guillén, J. M.; Araujo, C. Moyses Journal: RSC advances Issue: Volume 7:Issue 71(2017) Page Start: 44997 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Exploring Metastable Phases During Lithiation of Organic Battery Electrode Materials. Issue 12 (22nd April 2022) Authors: Carvalho, Rodrigo P.; Alhanash, Mirna; Marchiori, Cleber F. N.; Brandell, Daniel; Araujo, C. Moyses Journal: ChemSusChem Issue: Volume 15:Issue 12(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Modelling the Polymer Electrolyte/Li-Metal Interface by Molecular Dynamics simulations. (20th April 2017) Authors: Ebadi, Mahsa; Costa, Luciano T.; Araujo, C. Moyses; Brandell, Daniel Journal: Electrochimica acta Issue: Volume 234(2017) Page Start: 43 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Molecular origin of efficient hole transfer from non-fullerene acceptors: insights from first-principles calculations. Issue 39 (23rd September 2019) Authors: Benatto, Leandro; Marchiori, Cleber F. N.; Araujo, C. Moyses; Koehler, Marlus Journal: Journal of materials chemistry Issue: Volume 7:Issue 39(2019) Page Start: 12180 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. On the energy gap determination of organic optoelectronic materials: the case of porphyrin derivatives. Issue 3 (18th January 2022) Authors: Aderne, Rian E.; Borges, Bruno Gabriel A. L.; Ávila, Harold C.; von Kieseritzky, Fredrik; Hellberg, Jonas; Koehler, Marlus; Cremona, Marco; Roman, Lucimara S.; Araujo, C. Moyses; Rocco, Maria Luiza M.; Marchiori, Cleber F. N. Journal: Materials advances Issue: Volume 3:Issue 3(2022) Page Start: 1791 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗