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29 résultats

	Pour les 29 documents Envoyer sur ORCID RSS ATOM Exporter BibTeX XML-TEI CSV RTF EndNote PDF HTML Export avancé	Page :	triés par Pertinence Auteur A→Z Auteur Z→A Titre A→Z Titre Z→A Date de publication croissante Date de publication décroissante Date de dépôt croissante Date de dépôt décroissante

		Structure of the Polymer Backbones in polyMOF Materials Paulo Mileo , Shichen Yuan , Sergio Ayala , Pu Duan , Rocio Semino , et al. Journal of the American Chemical Society, 2020, 142 (24), pp.10863-10868. ⟨10.1021/jacs.0c04546⟩ Article dans une revue hal-02899958v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Microscopic Mechanism of the Thermal Amorphization of ZIF-4 and Melting of ZIF-zni Revealed via Molecular Dynamics and Machine Learning Techniques Emilio Mendez , Rocio Semino 2024 Pré-publication, Document de travail hal-04496626v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Force matching and iterative Boltzmann inversion coarse grained force fields for ZIF-8 Cecilia Alvares , Rocio Semino 2024 Pré-publication, Document de travail hal-04496651v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Modeling of Gas Transport through Polymer/MOF Interfaces: A Microsecond-Scale Concentration Gradient-Driven Molecular Dynamics Study Aydin Ozcan , Rocio Semino , Guillaume Maurin , A. Ozgur Yazaydin Chemistry of Materials, 2020, 32 (3), pp.1288-1296. ⟨10.1021/acs.chemmater.9b04907⟩ Article dans une revue hal-02502210v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Enhanced gas separation performance of 6FDA-DAM based mixed matrix membranes by incorporating MOF UiO-66 and its derivatives Mohd Zamidi Ahmad , Marta Navarro , Miloslav Lhotka , Beatriz Zornoza , Carlos Téllez , et al. Journal of Membrane Science, 2018, 558, pp.64 - 77. ⟨10.1016/j.memsci.2018.04.040⟩ Article dans une revue hal-01804668v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Computer Simulation of the Early Stages of Self-Assembly and Thermal Decomposition of ZIF-8 S. Balestra , R. Semino Journal of Chemical Physics, 2022, 157 (18), pp.184502. ⟨10.1063/5.0128656⟩ Article dans une revue hal-03892233v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Understanding of the Graphene Oxide/Metal-Organic Framework Interface at the Atomistic Scale Satyanarayana Bonakala , Anusha Lalitha , Jae Eun Shin , Farhad Moghadam , Rocio Semino , et al. ACS Applied Materials & Interfaces, 2018, 10 (39), pp.33619 - 33629. ⟨10.1021/acsami.8b09851⟩ Article dans une revue hal-01904859v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Role of MOF surface defects on the microscopic structure of MOF/polymer interfaces: A computational study of the ZIF-8/PIMs systems Rocio Semino , Naseem A. Ramsahye , Aziz Ghoufi , Guillaume Maurin Microporous and Mesoporous Materials, 2017, 254, pp.184-191. ⟨10.1016/j.micromeso.2017.02.031⟩ Article dans une revue hal-01631750v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Polymer Infiltration into Metal–Organic Frameworks in Mixed-Matrix Membranes Detected in Situ by NMR Pu Duan , Jessica Moreton , Sérgio S. M. Tavares , Rocio Semino , Guillaume Maurin , et al. Journal of the American Chemical Society, 2019, 141 (18), pp.7589-7595. ⟨10.1021/jacs.9b02789⟩ Article dans une revue hal-02152448v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Revealing the Transient Concentration of CO 2 in a Mixed-Matrix Membrane by IR Microimaging and Molecular Modeling Seungtaik Hwang , Rocio Semino , Beatriz Seoane , Marufa Zahan , Christian Chmelik , et al. Angewandte Chemie International Edition, 2018, 57 (18), pp.5156 - 5160. ⟨10.1002/anie.201713160⟩ Article dans une revue hal-01801028v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Covalent and Selective Grafting of Polyethylene Glycol Brushes at the Surface of ZIF-8 for the Processing of Membranes for Pervaporation Marvin Benzaqui , Rocio Semino , Florent Carn , Sérgio Rodrigues Tavares , Nicolas F Menguy , et al. ACS Sustainable Chemistry & Engineering, 2019, 7, pp.6629-6639. ⟨10.1021/acssuschemeng.8b05587⟩ Article dans une revue cea-02072200v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Rational design of mixed-matrix metal-organic framework membranes for molecular separations Shuvo Jit Datta , Alvaro Mayoral , Narasimha Murthy Srivatsa Bettahalli , Prashant Bhatt , Madhavan Karunakaran , et al. Science, 2022, 376 (6597), pp.1080-1087. ⟨10.1126/science.abe0192⟩ Article dans une revue hal-03753036v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Is Porosity at the MOF/Polymer Interface Necessarily an Obstacle to Optimal Gas-Separation Performances in Mixed Matrix Membranes? Dong Fan , Aydin Ozcan , Naseem Ramsahye , Dan Zhao , Guillaume Maurin , et al. ACS Materials Letters, 2021, 3 (4), pp.344-350. ⟨10.1021/acsmaterialslett.0c00560⟩ Article dans une revue hal-03230528v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Highly Efficient Proton Conduction in a Three-Dimensional Titanium Hydrogen Phosphate Paulo Mileo , Tanay Kundu , Rocio Semino , Virginie Benoit , Nathalie Steunou , et al. Chemistry of Materials, 2017, 29 (17), pp.7263 - 7271. ⟨10.1021/acs.chemmater.7b01850⟩ Article dans une revue hal-01649051v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Multifaceted Study of the Interactions between CPO-27-Ni and Polyurethane and Their Impact on Nitric Oxide Release Performance Simon Vornholt , Morven Duncan , Stewart Warrender , Rocio Semino , Naseem Ramsahye , et al. ACS Applied Materials & Interfaces, 2020, 12 (52), pp.58263-58276. ⟨10.1021/acsami.0c17937⟩ Article dans une revue hal-03134495v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Toward an Understanding of the Microstructure and Interfacial Properties of PIMs/ZIF-8 Mixed Matrix Membranes Marvin Benzaqui , Rocio Semino , Nicolas Menguy , Florent Carn , Tanay Kundu , et al. ACS Applied Materials & Interfaces, 2016, 8 (40), pp.27311--27321. ⟨10.1021/acsami.6b08954⟩ Article dans une revue hal-01840184v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Microscopic Model of the Metal-Organic Framework/Polymer Interface: A First Step toward Understanding the Compatibility in Mixed Matrix Membranes Rocio Semino , Naseem A. Ramsahye , Aziz Ghoufi , Guillaume Maurin ACS Applied Materials & Interfaces, 2016, 8 (1), pp.809-819. ⟨10.1021/acsami.5b10150⟩ Article dans une revue hal-01259519v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		A new kind of atlas of zeolite building blocks Benjamin Helfrecht , Rocio Semino , Giovanni Pireddu , Scott Auerbach , Michele Ceriotti Journal of Chemical Physics, 2019, 151 (15), pp.154112. ⟨10.1063/1.5119751⟩ Article dans une revue hal-02417178v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Proton Transport in a Highly Conductive Porous Zirconium-Based Metal-Organic Framework: Molecular Insight Daiane Damasceno Borges , Sabine Devautour-Vinot , H. Jobic , Jacques Ollivier , Farid Nouar , et al. Angewandte Chemie International Edition, 2016, 55 (12), pp.3919-3924. ⟨10.1002/anie.201510855⟩ Article dans une revue hal-01341744v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Computational Exploration of the Water Concentration Dependence of the Proton Transport in the Porous UiO-66(Zr)-(CO2H)(2) Metal-Organic Framework D. D. Borges , R. Semino , S. Devautour-Vinott , H. Jobic , F. Paesani , et al. Chemistry of Materials, 2017, 29 (4), pp.1569-1576. ⟨10.1021/acs.chemmater.6b04257⟩ Article dans une revue hal-01504810v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Ranking the synthesizability of hypothetical zeolites with the sorting hat Benjamin Helfrecht , Giovanni Pireddu , Rocio Semino , Scott Auerbach , Michele Ceriotti Digital Discovery, 2022, 1 (6), pp.779-789. ⟨10.1039/D2DD00056C⟩ Article dans une revue hal-03944057v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		An In-Situ Neutron Diffraction and DFT Study of Hydrogen Adsorption in a Sodalite-Type Metal-Organic Framework, Cu-BTTri Mehrdad Asgari , Rocio Semino , Pascal Schouwink , Ilia Kochetygov , Olga Trukhina , et al. European Journal of Inorganic Chemistry, 2019, 2019 (8), pp.1147-1154. ⟨10.1002/ejic.201801253⟩ Article dans une revue hal-02075545v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Computationally Assisted Assessment of the Metal‐Organic Framework/Polymer Compatibility in Composites Integrating a Rigid Polymer Sérgio Rodrigues Tavares , Naseem Ahmed Ramsahye , Karim Adil , Mohamed Eddaoudi , Guillaume Maurin , et al. Advanced Theory and Simulations, 2019, 2 (11), pp.1900116. ⟨10.1002/adts.201900116⟩ Article dans une revue hal-02900081v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Insights into the Enhancement of MOF/Polymer Adhesion in Mixed-Matrix Membranes via Polymer Functionalization Ionela-Daniela Carja , Sergio Rodrigues Tavares , Osama Shekhah , Aydin Ozcan , Rocio Semino , et al. ACS Applied Materials & Interfaces, 2021, 13 (24), pp.29041-29047. ⟨10.1021/acsami.1c03859⟩ Article dans une revue hal-03287991v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Putting Forward NUS-8-CO 2 H/PIM-1 as a Mixed Matrix Membrane for CO 2 Capture Dong Fan , Aydin Ozcan , Naseem Ramsahye , Guillaume Maurin , Rocio Semino ACS Applied Materials & Interfaces, 2022, 14 (14), pp.16820-16829. ⟨10.1021/acsami.2c00090⟩ Article dans une revue hal-03703192v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Understanding How Ligand Functionalization Influences CO 2 and N 2 Adsorption in a Sodalite Metal–Organic Framework Mehrdad Asgari , Rocio Semino , Pascal Schouwink , Ilia Kochetygov , Jacob Tarver , et al. Chemistry of Materials, 2020, 32 (4), pp.1526-1536. ⟨10.1021/acs.chemmater.9b04631⟩ Article dans une revue hal-02511777v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Pore-Networked Gels: Permanently Porous Ionic Liquid Gels with Linked Metal–Organic Polyhedra Networks Zaoming Wang , Aydin Ozcan , Gavin Craig , Frederik Haase , Takuma Aoyama , et al. Journal of the American Chemical Society, 2023, 145 (26), pp.14456-14465. ⟨10.1021/jacs.3c03778⟩ Article dans une revue hal-04192719v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Coarse-grained modeling of zeolitic imidazolate framework-8 using MARTINI force fields Cecilia M S Alvares , Guillaume Maurin , Rocio Semino Journal of Chemical Physics, 2023, 158 (19), pp.194107. ⟨10.1063/5.0145924⟩ Article dans une revue hal-04102586v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More
		Nucleation of zeolitic imidazolate frameworks: from molecules to nanoparticles Salvador Balestra , Bruno Martínez-Haya , Norge Cruz-Hernández , Dewi Lewis , Scott Woodley , et al. Nanoscale, 2023, 15 (7), pp.3504-3519. ⟨10.1039/D2NR06521E⟩ Article dans une revue hal-04013320v1	Envoyer sur ORCID Exporter BibTeX XML-TEI Dublin Core DC Terms EndNote DataCite Export avancé Partager Gmail Facebook X LinkedIn More

Filtrer vos résultats

Structure of the Polymer Backbones in polyMOF Materials

Microscopic Mechanism of the Thermal Amorphization of ZIF-4 and Melting of ZIF-zni Revealed via Molecular Dynamics and Machine Learning Techniques

Force matching and iterative Boltzmann inversion coarse grained force fields for ZIF-8

Modeling of Gas Transport through Polymer/MOF Interfaces: A Microsecond-Scale Concentration Gradient-Driven Molecular Dynamics Study

Enhanced gas separation performance of 6FDA-DAM based mixed matrix membranes by incorporating MOF UiO-66 and its derivatives

Computer Simulation of the Early Stages of Self-Assembly and Thermal Decomposition of ZIF-8

Understanding of the Graphene Oxide/Metal-Organic Framework Interface at the Atomistic Scale

Role of MOF surface defects on the microscopic structure of MOF/polymer interfaces: A computational study of the ZIF-8/PIMs systems

Polymer Infiltration into Metal–Organic Frameworks in Mixed-Matrix Membranes Detected in Situ by NMR

Revealing the Transient Concentration of CO 2 in a Mixed-Matrix Membrane by IR Microimaging and Molecular Modeling

Covalent and Selective Grafting of Polyethylene Glycol Brushes at the Surface of ZIF-8 for the Processing of Membranes for Pervaporation

Rational design of mixed-matrix metal-organic framework membranes for molecular separations

Is Porosity at the MOF/Polymer Interface Necessarily an Obstacle to Optimal Gas-Separation Performances in Mixed Matrix Membranes?

Highly Efficient Proton Conduction in a Three-Dimensional Titanium Hydrogen Phosphate

Multifaceted Study of the Interactions between CPO-27-Ni and Polyurethane and Their Impact on Nitric Oxide Release Performance

Toward an Understanding of the Microstructure and Interfacial Properties of PIMs/ZIF-8 Mixed Matrix Membranes

Microscopic Model of the Metal-Organic Framework/Polymer Interface: A First Step toward Understanding the Compatibility in Mixed Matrix Membranes

A new kind of atlas of zeolite building blocks

Proton Transport in a Highly Conductive Porous Zirconium-Based Metal-Organic Framework: Molecular Insight

Computational Exploration of the Water Concentration Dependence of the Proton Transport in the Porous UiO-66(Zr)-(CO2H)(2) Metal-Organic Framework

Ranking the synthesizability of hypothetical zeolites with the sorting hat

An In-Situ Neutron Diffraction and DFT Study of Hydrogen Adsorption in a Sodalite-Type Metal-Organic Framework, Cu-BTTri

Computationally Assisted Assessment of the Metal‐Organic Framework/Polymer Compatibility in Composites Integrating a Rigid Polymer

Insights into the Enhancement of MOF/Polymer Adhesion in Mixed-Matrix Membranes via Polymer Functionalization

Putting Forward NUS-8-CO 2 H/PIM-1 as a Mixed Matrix Membrane for CO 2 Capture

Understanding How Ligand Functionalization Influences CO 2 and N 2 Adsorption in a Sodalite Metal–Organic Framework

Pore-Networked Gels: Permanently Porous Ionic Liquid Gels with Linked Metal–Organic Polyhedra Networks

Coarse-grained modeling of zeolitic imidazolate framework-8 using MARTINI force fields

Nucleation of zeolitic imidazolate frameworks: from molecules to nanoparticles