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Publications

^#Co-first author; ^*Corresponding author

Full publications can be found in my Google Scholar

2024

D. Fan, S. Naskar, G. Maurin^*, Unconventional mechanical and thermal behaviours of MOF CALF-20. Nature Communications, 2024, 15, 3251 Open Access

D. Fan^*, A. Ozcan, P. Lyu, G. Maurin^*, Unravelling abnormal in-plane stretchability of two-dimensional metal–organic frameworks by machine learning potential molecular dynamics. Nanoscale, 2024, 15, 5294-5302 Open Access

S. Liu^#, R. Dupuis^#, D. Fan^#, S. Benzaria, M. Bonneau, P. Bhatt, M. Eddaoudi^*, G. Maurin^*, Machine learning potential for modelling H2 adsorption/diffusion in MOFs with open metal sites. Chemical Science, 2024, 16, 3438-3447 Open Access

B. Chen, D. Fan, R. Pinto, I. Dovgaliuk, S. Nandi, D. Chakraborty, N. Moncada, A. Vimont, C. McMonagle, M. Bordonhos, A. Mohtar, I. Cornu, P. Florian, N. Heymans, M. Daturi, G. Weireld, M. Pinto, F. Nouar, G. Maurin^*, G. Mouchaham^*, C. Serre^*, A Scalable Robust Microporous Al-MOF for Post-Combustion Carbon Capture. Advanced Science, 2024, 2401070 Open Access

R. Hardian, J. Jia, A. Diaz‐Marquez, S. Naskar, D. Fan, O. Shekhah, G. Maurin, M. Eddaoudi^*, G. Szekely^*, Design of Mixed-Matrix MOF Membranes with Asymmetric Filler Density and Intrinsic MOF/Polymer Compatibility for Enhanced Molecular Sieving. Advanced Materials, 2024, 2314206 Open Access

S. Liu, V. Diez-Cabanes, D. Fan, L. Peng, Y. Fang, M. Antonietti^*, G. Maurin^*. Tailoring Metal-Ion-Doped Carbon Nitrides for Photocatalytic Oxygen Evolution Reaction. ACS Catalysis, 2024, 14, 4, 2562–2571 DOI

K. Gopalsamy, D. Fan, S. Naskar, Y. Magnin, G. Maurin^*. Engineering of an Isoreticular Series of CALF-20 Metal–Organic Frameworks for CO2 Capture. ACS Applied Engineering Materials, 2024, 2, 1, 96-103 DOI

J. Obesosup^#, K. Gopalsamysup^#, M. Wahiduzzamansup^#, E. Martínez-Ahumada, D. Fan, Hugo Lara-García, F. Carmona, G. Maurin^*, I. Ibarra^*, J. Navarro^*. Impact of Ni(II) coordinatively unsaturated sites and coordinated water molecules on SO2 adsorption by a MOF with octanuclear metal clusters. Journal of Materials Chemistry A, Accepted DOI

C. Navarro, M. Antonino, P. Escamilla, V. Cabanes, D. Fan, P. Atienzar, B. Ferrer, I. Vayá, G. Maurin, H. Baldoví^*, S. Navalón^*. Solar-assisted photocatalytic water splitting using defective UiO-66 solids from modulated synthesis. Nano Research, 2024, 17, 4134–4150 DOI

2023

S. Naskar, D. Fan, A. Ghoufi, G. Maurin^*, Microscopic insight into the shaping of MOFs and its impact on CO2 capture performance. Chemical Science, 2023, 14, 10435-10445 Open Access

S. Kandambeth, V. S. Kale, D. Fan, J. A. Bau, P. M. Bhatt, S. Zhou, A. Shkurenko, M. Rueping, G. Maurin, O. Shekhah, M. Eddaoudi^*, Unveiling Chemically Robust Bimetallic Squarate-Based Metal–Organic Frameworks for Electrocatalytic Oxygen Evolution Reaction. Advanced Energy Materials, 2023, 13, 2202964 DOI

A. Baldoví, R. Angel, G. Mouchaham^*, S. Liu, D. Fan, G. Maurin, S. Navalón, C. Serre^*, H. Garcia^*, Active site imprinting on Ti oxocluster metal–organic frameworks for photocatalytic hydrogen release from formic acid. Energy & Environmental Science, 2023, 16, 167-177 DOI

H. Hamoud, L. Wolski, H. Abdelli, R. Chtourou, O. Lebedev, C. Martin, D. Fan, G. Maurin, A. Maignan, M. El-Roz, Earth-Abundant-Based Photocatalysts for Efficient and Selective H2 Production through Reforming of Formic Acid under Visible Light, ACS Catalysis, 2023, 13, 24, 16266–16278 DOI

HZ. Gao, X. Shen, P. Lyu^*, C. Xu^*, D. Fan, L. Sun^*, Introducing Relatively Isolated In/Out-Gap Bands in Cs2XCl6 (X = Sn, Hf, Zr, Ti) via B-Site Substitution: A Route to Brighter Luminescence and Tunable Emission Wavelengths. Advanced Optical Materials, 2023, 11, 2300956 DOI

Y. Cheng, B. Joarder, S. Datta, N. Alsadun, D. Poloneeva, D. Fan, R. Khairova, A. Bavykina, J. Jia, O. Shekhah, A. Shkurenko, G. Maurin, J. Gascon, M. Eddaoudi^*, Mixed Matrix Membranes with Surface Functionalized Metal–Organic Framework Sieves for Efficient Propylene/Propane Separation. Advanced Materials, 2023, 35, 2300296 Open Access

2022

S. Jit, A. Mayoral, N. Bettahalli, P. Bhatt, M. Karunakaran, I. Carja, D. Fan, P. Mileo, R. Semino, G. Maurin, O. Terasaki, M. Eddaoudi^*, Engineering MOF surface defects in mixed matrix membranes: An effective strategy to enhance MOF/polymer adhesion and control interfacial gas transport. Science, 2022, 376,1080-1087 DOI

D. Fan^#, A. Ozcan^#, N. Ramsahye, G. Maurin, R. Semino^*, Putting Forward NUS-8-CO2H/PIM-1 as a Mixed Matrix Membrane for CO2 Capture. ACS Applied Materials & Interfaces, 2022, 14, 16820-16829 DOI

D. Fan^#, A. Ozcan^#, O. Shekhah, R. Semino, M. Eddaoudi^*, G. Maurin^*, Engineering MOF surface defects in mixed matrix membranes: An effective strategy to enhance MOF/polymer adhesion and control interfacial gas transport. Journal of Membrane Science Letters, 2022, 2, 100029 Open Access

C. Chen^#, D. Fan^#, H. Xu, M. Jiang, X. Li, S. Lu, C. Ke, X. Hu^*, Monoatomic tantalum induces ordinary-pressure phase transition from graphite to n-type diamond. Carbon, 2022, 196, 466-473 DOI

C. Chen^#, D. Guo^#, D. Fan^#, S. Lu, M. Jiang, X. Li, X. Hu^*, Semiconductive vertical graphene nanoribbons self-assembled on diamond (100) surface by oxidation: A DFT study. Applied Surface Science, 2022, 604, 154646 DOI

H. Hamoud, P. Damacet, D. Fan, N. Assaad, O. Lebedev, A. Krystianiak, A. Gouda, O. Heintz, M. Daturi, G. Maurin, M. Hmadeh^*, M. El-Roz^*, Selective Photocatalytic Dehydrogenation of Formic Acid by an In Situ-Restructured Copper-Postmetalated Metal–Organic Framework under Visible Light. Journal of the American Chemical Society, 2022, 144, 36, 16433-16446 Open Access

2021

D. Fan^#, A. Ozcan^#, N. Ramsahye, D. Zhao, G. Maurin, R. Semino^*, Is Porosity at the MOF/Polymer Interface Necessarily an Obstacle to Optimal Gas-Separation Performances in Mixed Matrix Membranes? ACS Materials Letters, 2021, 3, 344–350 DOI

T. H. Lee, A. Ozcan, I. Park, D. Fan, J. K. Jang, P. G. M. Mileo, S. Y. Yoo, J. S. Roh, J. H. Kang, B. K. Lee, Y. H. Cho, R. Semino, H. W. Kim, G. Maurin, H. B. Park^*, Disclosing the Role of Defect-Engineered Metal–Organic Frameworks in Mixed Matrix Membranes for Efficient CO2 Separation: A Joint Experimental-Computational Exploration. Advanced Functional Materials, 2021, 31, 2103973 DOI

A. Olvera, J. Zárate, E. Ahumada, D. Fan, M. Ramirez, R. Cavazos, V. Martis, D. Williams, E. González, G. Maurin^*, I. Ibarra^*, SO2 Capture by Two Aluminum-Based MOFs: Rigid-like MIL-53(Al)-TDC versus Breathing MIL-53(Al)-BDC. ACS Applied Materials & Interfaces, 2021, 13, 39363–39370 DOI

2020

D. Fan, S. Lu, C. Chen, M. Jiang, X. Li, X. Hu^*, Versatile two-dimensional boron monosulfide polymorphs with tunable bandgaps and superconducting properties. Applied Physics Letters, 2020, 117, 013103 DOI

D. Fan, C. Chen, S. Lu, X. Li, M. Jiang, X. Hu^*, Highly Stable Two-Dimensional Iron Monocarbide with Planar Hypercoordinate Moiety and Superior Li-Ion Storage Performance. ACS Applied Materials & Interfaces, 2020, 12, 30297–30303 DOI

C. Ke^#, D. Fan^#, C. Chen, X. Li, M. Jiang, X. Hu^*, Two-dimensional tetragonal transition-metal carbide anodes for non-lithium-ion batteries. Physical Chemistry Chemical Physics, 2020, 22, 13680-13688 DOI

2017~2019

D. Fan, A. Golov, A. Kabanov, C. Chen, S. Lu, X. Li, M. Jiang, X. Hu^*, A New sp2–sp3-Hybridized Metallic Carbon Network for Lithium-Ion Battery Anode with Enhanced Safety and Lithium-Ion Diffusion Rate. The Journal of Physical Chemistry C, 2019, 123, 15412-15418 DOI

D. Fan^#, S. Lu^#, C. Chen, M. Jiang, X. Li, X. Hu^*, A novel hydrogenated boron–carbon monolayer with high stability and promising carrier mobility. Physical Chemistry Chemical Physics, 2019, 21, 2572-2577 DOI

D. Fan^#, S. Lu^*, A. Golov, A. Kabanov, X. Hu^*, D-carbon: Ab initio study of a novel carbon allotrope. The Journal of Chemical Physics, 2018, 21, 2572-2577 DOI

D. Fan^#, S. Lu^#*, Y. Guo, X. Hu^*, Two-Dimensional Tetragonal Titanium Carbide: a High-Capacity and High-Rate Battery Material. The Journal of Physical Chemistry C, 2018, 122, 15118-15124 DOI

D. Fan^#, S. Lu^#*, Y. Guo, X. Hu^*, Two-dimensional stoichiometric boron carbides with unexpected chemical bonding and promising electronic properties. Journal of Materials Chemistry C, 2018, 6, 1651-1658 DOI

D. Fan, S. Lu^*, Y. Guo, X. Hu^*, Novel bonding patterns and optoelectronic properties of the two-dimensional Si x C y monolayers. Journal of Materials Chemistry C, 2017, 5, 3561-3567 DOI