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Xueying Lu, Yajing Sun and Wenping Hu

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The use of collective variables and enhanced sampling in the simulations of existing and emerging microporous materials

Konstantin Stracke and Jack D. Evans

Nanoscale, 2024, 16, 9186
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Rotational Dynamics of Linkers in Metal–Organic Frameworks

Adrian Gonzalez-Nelson, François-Xavier Coudert and Monique A. van der Veen

Nanomaterials, 2019, 9, 330
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Regulating Adsorption Behaviors in Crystalline Porous Materials by External Electric Fields

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Small Science, 2025, 5
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Image of the solid-state rotary motion encoded in the dielectric response

Marzena Rams-Baron, Alfred Błażytko, Karolina Jurkiewicz, Piotr Lodowski, Maria Książek, Joachim Kusz, Witold Mozga, Marta Fordymacka, Mahshid Teymouri, Julia Krzywik and Marian Paluch

Rep. Prog. Phys., 2024, 87, 108002
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Electric‐Field Induced Unconventional Flexibility of MIL‐Series MOFs and Its Application in Carbon Capture

Xiangwei Huang, Kaifei Chen, Xingbo Wang, Deng Hu, Lina Zhang, Hongyu Zhao, Wei Wei and Nannan Sun

Small, 2026, 22
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Molecular Insight into the Electric Field Regulation of N2 and CH4 Adsorption in the Trapdoor ZSM-25 Zeolites

Kaifei Chen, Seyed Hesam Mousavi, Zhi Yu, Lina Zhang, Qinfen Gu, Randall Q. Snurr, Paul A. Webley, Nannan Sun and Gang Kevin Li

ACS Appl. Mater. Interfaces, 2024, 16, 51129
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Stimuli-responsive coordination polymers toward next-generation smart materials and devices

Feifan Lang, Jiandong Pang and Xian-He Bu

eScience, 2024, 4, 100231
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Electrical Regulation of CO2 Adsorption in the Metal–Organic Framework MIL-53

Kaifei Chen, Ranjeet Singh, Jining Guo, Yalou Guo, Ali Zavabeti, Qinfen Gu, Randall Q. Snurr, Paul A. Webley and Gang Kevin Li

ACS Appl. Mater. Interfaces, 2022, 14, 13904
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Metal–Organic Framework Breathing in the Electric Field: A Theoretical Study

Andrei L. Kolesnikov, Yury A. Budkov, Jens Möllmer, Michael G. Kiselev and Roger Gläser

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Impact of Synthetic Conditions on the Morphology and Crystallinity of FDMOF-1(Cu) Thin Films

Olivier Lugier, Unnati Pokharel and Sonia Castellanos

Crystal Growth & Design, 2020, 20, 5302
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Towards artificial molecular factories from framework-embedded molecular machines

Simon Krause and Ben L. Feringa

Nat Rev Chem, 2020, 4, 550
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Die Chemie verformbarer poröser Kristalle – Strukturdynamik und Gasadsorptionseigenschaften

Simon Krause, Nobuhiko Hosono and Susumu Kitagawa

Angewandte Chemie, 2020, 132, 15438
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Dielectric response of metal–organic frameworks as a function of confined guest species investigated by molecular dynamics simulations

Babak Farhadi Jahromi and Rochus Schmid

The Journal of Chemical Physics, 2024, 160
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Chemistry of Soft Porous Crystals: Structural Dynamics and Gas Adsorption Properties

Simon Krause, Nobuhiko Hosono and Susumu Kitagawa

Angew Chem Int Ed, 2020, 59, 15325
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Benzothiadiazole-based rotation and possible antipolar order in carboxylate-based metal-organic frameworks

Jennifer Schnabel, Arthur Schulz, Peter Lunkenheimer and Dirk Volkmer

Commun Chem, 2023, 6
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Computational design of a ferroelectric framework material based on dipolar rotors

Thomas Bergler, Sabuhi Badalov, Achim Wixforth, Dirk Volkmer and Harald Oberhofer

The Journal of Chemical Physics, 2026, 164
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Structural Change and Radical Generation of a Cadmium-Based Metal–Organic Framework Induced by an Electric Field

Guo-Xia Jin, Zi-Lin Su, Cong-Cong Han, Li-Cong Han, Fu-Bo Wang, Xiangwen Wu, Xianliang Zhao, Meichao Cai, Haiying Wang and Jian-Ping Ma

Inorg. Chem., 2023, 62, 8784
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Regulating adsorption performance of zeolites by pre-activation in electric fields

Kaifei Chen, Zhi Yu, Seyed Hesam Mousavi, Ranjeet Singh, Qinfen Gu, Randall Q. Snurr, Paul A. Webley and Gang Kevin Li

Nat Commun, 2023, 14
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Halogens On, H-Bonds Off—Insights into Structure Control of Dihalogenated Imidazole Derivatives

Luca Mensing, Marcus Layh and Marian Hebenbrock

Crystals, 2025, 15, 1000
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Electrical and Mechanical Controllability of Rotor Dynamics in MOF Thin Films Revealed by AFM-IR

Da Shu, Ruipeng Fan, Songyou Yao, He Jiang, Xiaoyue Zhang and Yue Zheng

J. Phys. Chem. C, 2024, 128, 12551
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Halogenated Metal–Organic Framework Glasses and Liquids

Jingwei Hou, María Laura Ríos Gómez, Andraž Krajnc, Aoife McCaul, Shichun Li, Alice M. Bumstead, Adam F. Sapnik, Zeyu Deng, Rijia Lin, Philip A. Chater, Dean S. Keeble, David A. Keen, Dominique Appadoo, Bun Chan, Vicki Chen, Gregor Mali and Thomas D. Bennett

J. Am. Chem. Soc., 2020, 142, 3880
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Tuning the Electric Field Response of MOFs by Rotatable Dipolar Linkers

Johannes P. Dürholt, Babak Farhadi Jahromi and Rochus Schmid

ACS Cent. Sci., 2019, 5, 1440
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Dynamic Electric Field Alignment of Metal–Organic Framework Microrods

Fei Cheng, Adam J. Young, Jean-Sebastien G. Bouillard, Neil T. Kemp, Rémy Guillet-Nicolas, Connor H. Hall, David Roberts, Ayoub H. Jaafar, Ali M. Adawi, Freddy Kleitz, Arnout Imhof, Michael R. Reithofer and Jia Min Chin

J. Am. Chem. Soc., 2019, 141, 12989
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