Frederik Tielens

Scopus Author ID ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 18

Top Topics

Aqueous Solution

Molecular Dynamics

Transition Metal

Top Venues

Nanomaterials (Basel, Switzerland)

Physical chemistry chemical physics : PCCP

Chemistry (Weinheim an der Bergstrasse, Germany)

The journal of physical chemistry. B

This page only lists publications with an associated author ORCID identifier.

Publications

Beata Taudul, Frederik Tielens, Monica Calatayud
Raman Characterization of Plastics: A DFT Study of Polystyrene. The journal of physical chemistry. B (2024)
Beata Taudul, Frederik Tielens, Monica Calatayud
Raman Characterization of Plastics: A DFT Study of Polystyrene. The journal of physical chemistry. B 128 (17) (2024)
Frederik Tielens
Special Issue "Theoretical Calculation and Molecular Modeling of Nanomaterials". Nanomaterials (Basel, Switzerland) 13 (17) (2023)
Beata Taudul, Frederik Tielens, Monica Calatayud
On the Origin of Raman Activity in Anatase TiO 2 (Nano)Materials: An Ab Initio Investigation of Surface and Size Effects. Nanomaterials (Basel, Switzerland) 13 (12) (2023)
Beata Taudul, Frederik Tielens, Monica Calatayud
On the Origin of Raman Activity in Anatase TiO 2 (Nano)Materials: An Ab Initio Investigation of Surface and Size Effects. Nanomaterials (Basel, Switzerland) 13 (12) (2023)
Beata Taudul, Frederik Tielens, Monica Calatayud
On the Origin of Raman Activity in Anatase TiO 2 (Nano)Materials: An Ab Initio Investigation of Surface and Size Effects. Nanomaterials (Basel, Switzerland) 13 (12) (2023)
Yangyang Su, Jelle Vekeman, Flavio Siro Brigiano, Etienne Paul Hessou, Yuheng Zhao, Diane Sorgeloos, Marc Raes, Tom Hauffman, Kehzi Li, Frederik Tielens
A molecular understanding of citrate adsorption on calcium oxalate polyhydrates. Physical chemistry chemical physics : PCCP (2023)
Yangyang Su, Etienne P Hessou, Estefania Colombo, Gustavo Belletti, Ali Moussadik, Ivan T Lucas, Vincent Frochot, Michel Daudon, Stéphan Rouzière, Dominique Bazin, Kezhi Li, Paola Quaino, Frederik Tielens
Crystalline structures of L-cysteine and L-cystine: a combined theoretical and experimental characterization. Amino acids 54 (8) (2022)
Jelle Vekeman, Qing Wang, Xavier Deraet, Dominique Bazin, Frank De Proft, Hazar Guesmi, Frederik Tielens
Synergistic Effects in the Activity of Nano-Transition-Metal Clusters Pt<sub>12</sub> M (M=Ir, Ru or Rh) for NO Dissociation. Chemphyschem : a European journal of chemical physics and physical chemistry 23 (21) (2022)
Jelle Vekeman, Javier Torres, Cristina Eugenia David, Els Van de Perre, Karl Martin Wissing, Emmanuel Letavernier, Dominique Bazin, Michel Daudon, Agnieszka Pozdzik, Frederik Tielens
In Search of an Efficient Complexing Agent for Oxalates and Phosphates: A Quantum Chemical Study. Nanomaterials (Basel, Switzerland) 11 (7) (2021)
Xavier Deraet, Jan Turek, Mercedes Alonso, Frederik Tielens, Stefaan Cottenier, Paul W Ayers, Bert M Weckhuysen, Frank de Proft
Reactivity of Single Transition Metal Atoms on a Hydroxylated Amorphous Silica Surface: A Periodic Conceptual DFT Investigation. Chemistry (Weinheim an der Bergstrasse, Germany) 27 (19) (2021)
Mats Denayer, Jelle Vekeman, Frederik Tielens, Frank De Proft
Towards a predictive model for polymer solubility using the noncovalent interaction index: polyethylene as a case study. Physical chemistry chemical physics : PCCP 23 (44) (2021)
Baohuan Wei, Frederik Tielens, Monica Calatayud
Understanding the Role of Rutile TiO2 Surface Orientation on Molecular Hydrogen Activation. Nanomaterials (Basel, Switzerland) 9 (9) (2019)
Fatima Aouidat, Sarah Boumati, Memona Khan, Frederik Tielens, Bich-Thuy Doan, Jolanda Spadavecchia
Design and Synthesis of Gold-Gadolinium-Core-Shell Nanoparticles as Contrast Agent: a Smart Way to Future Nanomaterials for Nanomedicine Applications. International journal of nanomedicine 14 (2019)
Etienne Paul Hessou, Miguel Ponce-Vargas, Jean-Baptiste Mensah, Frederik Tielens, Juan Carlos Santos, Michaël Badawi
Dibenzyl Disulfide Adsorption on Cationic Exchanged Faujasites: A DFT Study. Nanomaterials (Basel, Switzerland) 9 (5) (2019)
Maciej Gierada, Ivan Petit, Jarosław Handzlik, Frederik Tielens
Hydration in silica based mesoporous materials: a DFT model. Physical chemistry chemical physics : PCCP 18 (48) (2018)
Santosh Kumar Meena, Claire Goldmann, Douga Nassoko, Mahamadou Seydou, Thomas Marchandier, Simona Moldovan, Ovidiu Ersen, François Ribot, Corinne Chanéac, Clément Sanchez, David Portehault, Frederik Tielens, Marialore Sulpizi
Nanophase Segregation of Self-Assembled Monolayers on Gold Nanoparticles. ACS nano 11 (7) (2017)
Hazar Guesmi, Noelia B Luque, Elizabeth Santos, Frederik Tielens
Does the S-H Bond Always Break after Adsorption of an Alkylthiol on Au(111)? Chemistry (Weinheim an der Bergstrasse, Germany) 23 (6) (2016)