José R. B. Gomes
@JoseRBGomes
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Computational Chemist, University of Aveiro
Portugal
Joined October 2020
It’s time to show gratitude to the partnerships that powered JORNADAS CICECO 2025 - and to all who contributed to making this event possible.
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Excited to share our latest Chemical Engineering Journal paper on MIL-160 MOF for efficient & sustainable biogas upgrading! Led by PhD student @marta_bordonhos w/ @moiseslpinto , we combine experimental and computational insights across scales. https://t.co/xxAjlOwtzx
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Share your research and be part of the vibrant scientific dialogue at Jornadas CICECO 2025! The poster session is a unique opportunity to showcase your work, exchange ideas, and receive valuable feedback. Submit your poster by 12 September @ https://t.co/gdNaeccnh9.
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On 9 October 2025, the CICECO community gathers at Casa da Cultura de Ílhavo for the Jornadas CICECO 2025 under the theme: “Navigating the Borders of Knowledge.” We look forward to welcoming you! Registration deadline: 5th September Subscribe at: https://t.co/8euQM3ZYgi
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Opening session of ECOSS 38 (Braga, Portugal), chaired by Prof. Maria Natália Cordeiro and Prof. João Pedro Araújo, both from @UPorto.
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The role of oxygen in the synthesis of the Mo2CTx MXene from the Mo2Ga2C MAX phase - now published in Physical Chemistry Chemical Physics
pubs.rsc.org
MAX phases are layered materials that have been known for over 60 years and MXenes are their metaphorical children, a family of two-dimensional (2D) materials that appeared in 2011. MXenes are often...
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👏 Congrats to Prof. Hermenegildo García on receiving the 🇵🇹🇪🇸 Portuguese-Spanish Chemistry Award (SPQ & RSEQ)! Honored to attend his excellent Lourenço-Madinaveitia Lecture at #XXIXENSPQ, held at the University of Coimbra (20-23 July '25. Grateful for the inspiring discussions!
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Just out! Our new paper “A Machine Learning Perspective on the Brønsted–Evans–Polanyi Relation in Water–Gas Shift Catalysis on MXenes” is now published open access in Wiley’s Advanced Intelligent Discovery. 🔗 https://t.co/wObnwfGpaS
#Catalysis #MachineLearning #MXenes #CompChem
advanced.onlinelibrary.wiley.com
Machine learning predicts activation energies for key steps in the water-gas shift reaction on 92 MXenes. Random Forest is identified as the most accurate model. Reaction energy and reactant LogP...
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Don’t miss this unique opportunity to contribute to and learn from the cutting edge of MXene research. We look forward to your participation! More information with the following link - https://t.co/3eZ86ytfso
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🚨 Exciting news! 🚨 I’m co-organizing the MXene 2025 Symposium in Bratislava, Slovakia on Sept 7-12, 2025, as part of the NAP-2025 IEEE International Conference. Join us for expert lectures on the latest advances in MXenes! More details at 🔗 https://t.co/JHSdRR5nqF
#MXenes
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Glad to share Kais work on the Prediction of Adsorption Energies on MXene Surfaces Using #MachineAI published in The Journal of Physical Chemistry C | w/ @tlpgalvao @ciceco_ua
pubs.acs.org
Efficient prediction of gas-phase adsorption energies on MXene surfaces is critical for advancing materials science applications of these materials. This study integrates data from density functional...
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New publication! @ciceco_ua @tlpgalvao Our latest review in npj 2D Materials and Applications focuses on first-principles and machine-learning approaches for understanding and predicting MXene properties. Read more: https://t.co/NxJLV8l7w6
#MXenes #DFT #MachineLearning #AIC3
nature.com
npj 2D Materials and Applications - First-principles and machine-learning approaches for interpreting and predicting the properties of MXenes
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Glad to be participating in this wonderful workshop organized by Giovanni di Liberto and Gianvito Vilé in Milan, Italy.
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Congratulations again to Prof. @FrancescIllas and Prof. @gianpacc hioni on their 70th birthdays! A big thanks to their teams at @UniBarcelona and @unimib for the fantastic organization of Twins in Catalysis: Merging Theory and Experiment in their honor. 🎉
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Excited to announce our work titled MXene Termination and Stacking Bias on the Reverse Water Gas Shift Reaction Catalysis, to be featured in the special issue of Mat Today Catal. on MXenes as emerging well-defined heterogeneous catalysts. Check it out: https://t.co/WM8RQ5eURV
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