关注
Marco Bernabei
Marco Bernabei
Senior Digital Scientist, Repsol Technology Lab
在 repsol.com 的电子邮件经过验证
标题
引用次数
引用次数
年份
Percolation and three-dimensional structure of supercritical water
M Bernabei, A Botti, F Bruni, MA Ricci, AK Soper
Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 78 (2 …, 2008
782008
Fluids of semiflexible ring polymers: effective potentials and clustering
M Bernabei, P Bacova, AJ Moreno, A Narros, CN Likos
Soft Matter 9 (4), 1287-1300, 2013
722013
Dynamic arrest in polymer melts: Competition between packing and intramolecular barriers
M Bernabei, AJ Moreno, J Colmenero
Physical review letters 101 (25), 255701, 2008
552008
Cluster glasses of semiflexible ring polymers
MZ Slimani, P Bacova, M Bernabei, A Narros, CN Likos, AJ Moreno
ACS macro letters 3 (7), 611-616, 2014
492014
Cluster glasses of ultrasoft particles
D Coslovich, M Bernabei, AJ Moreno
The Journal of Chemical Physics 137 (18), 2012
302012
The role of intramolecular barriers on the glass transition of polymers: Computer simulations versus mode coupling theory
M Bernabei, AJ Moreno, J Colmenero
The Journal of chemical physics 131 (20), 2009
292009
From caging to Rouse dynamics in polymer melts with intramolecular barriers: A critical test of the mode coupling theory
M Bernabei, AJ Moreno, E Zaccarelli, F Sciortino, J Colmenero
The Journal of Chemical Physics 134 (2), 2011
212011
Percolation and clustering in supercritical aqueous fluids
M Bernabei, MA Ricci
Journal of Physics: Condensed Matter 20 (49), 494208, 2008
212008
Molecular simulations of surfactant adsorption on iron oxide from hydrocarbon solvents
PN Acero, S Mohr, M Bernabei, C Fernández, B Dominguez, JP Ewen
Langmuir 37 (50), 14582-14596, 2021
142021
Out-of-oblivion cage molecules and their porous crystalline phases
IG Garcia, M Bernabei, RP Soto, M Haranczyk
Crystal Growth & Design 17 (11), 5614-5619, 2017
122017
In silico design and assembly of cage molecules into porous molecular materials
M Bernabei, R Pérez-Soto, IG García, M Haranczyk
Molecular Systems Design & Engineering 3 (6), 942-950, 2018
112018
Chain dynamics in nonentangled polymer melts: A first-principle approach for the role of intramolecular barriers
M Bernabei, AJ Moreno, E Zaccarelli, F Sciortino, J Colmenero
Soft Matter 7 (4), 1364-1368, 2011
112011
Computational discovery of a large-imine-cage-based porous molecular material and its application in water desalination
M Bernabei, RP Soto, IG García, M Haranczyk
Molecular Systems Design & Engineering 4 (4), 912-920, 2019
62019
Toward Automated Tools for Characterization of Molecular Porosity
IG García, M Bernabei, M Haranczyk
Journal of Chemical Theory and Computation 15 (1), 787-798, 2018
52018
Static and dynamic contributions to anomalous chain dynamics in polymer blends
M Bernabei, AJ Moreno, J Colmenero
Journal of Physics: Condensed Matter 23 (23), 234119, 2011
52011
Design of new dispersants using machine learning and visual analytics
MJ Martínez, R Naveiro, AJ Soto, P Talavante, SH Kim Lee, ...
Polymers 15 (5), 1324, 2023
32023
Artificial Intelligence in Tribology: Design of new dispersants using artificial intelligence tools
NE Campillo, P Talavante, I Ponzoni, AJ Soto, MJ Martínez, R Naveiro, ...
Proceedings of the 23rd International Colloquium Tribology: Industrial and …, 2022
22022
Towards stable porous crystalline phases of molecular belts
M Bernabei, R Pérez-Soto, IG García, M Haranczyk
CrystEngComm 19 (46), 6932-6935, 2017
22017
Structural relaxation and chain dynamics in polymer melts: a computational investigation on the role of the intramolecular barriers
M Bernabei
Universidad del País Vasco, 2011
12011
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