Ultra-large supramolecular coordination cages composed of endohedral Archimedean and Platonic bodies

Autor: Kevin Byrne, Muhammad Zubair, Nianyong Zhu, Xiao-Ping Zhou, Daniel S. Fox, Hongzhou Zhang, Brendan Twamley, Matthew J. Lennox, Tina Düren, Wolfgang Schmitt

Publikováno v: Nature Communications, Vol 8, Iss 1, Pp 1-9 (2017)

Host–guest chemistry in hollow coordination cages can be exploited for a range of applications, but is often limited by inner cavity dimensions. Here, Schmitt and co-workers fabricate supramolecular keplerates that possess ultra-large cross-section

Externí odkaz: https://doaj.org/article/f67df6ac5116401aa0ecfbbc894a1511

Effect of Pore Geometry on Ultra-Densified Hydrogen in Microporous Carbons

Autor: Tina Düren, Volker Presser, Zhili Dong, Lui R. Terry, Yanan Fang, Svemir Rudić, Valeska P. Ting, Matthew J. Lennox, Stéphane Rols, Sébastien Rochat, Benjamin Krüner, Alexander J. Porter, Alexander J. O'Malley, Timothy J. Mays, Mi Tian

Publikováno v: Tian, M, Lennox, M J, O'Malley, A J, Porter, A J, Krüner, B, Rudić, S, Mays, T J, Düren, T, Presser, V, Terry, L R, Rols, S, Fang, Y, Dong, Z, Rochat, S & Ting, V P 2021, ' Effect of Pore Geometry on Ultra-Densified Hydrogen in Microporous Carbons ', Carbon, vol. 173, no. 3, pp. 968-979 . https://doi.org/10.1016/j.carbon.2020.11.063
'Carbon ', vol: 173, pages: 968-979 (2021)

Our investigations into molecular hydrogen (H2) confined in microporous carbons with different pore geometries at 77 K have provided detailed information on effects of pore shape on densification of confined H2 at pressures up to 15 MPa. We selected

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0c23720d2d85f665167570204193df62
https://research-information.bris.ac.uk/en/publications/49e396c2-831b-4e0d-8082-104fbbd8d2da

The right isotherms for the right reasons? Validation of generic force fields for prediction of methane adsorption in metal-organic frameworks

Autor: Elena Besley, Alice Henley, Matthew J. Lennox, Michelle Bound

Publikováno v: Lennox, M J, Bound, M, Henley, A & Besley, E 2017, ' The right isotherms for the right reasons? Validation of generic force fields for prediction of methane adsorption in metal-organic frameworks ', Molecular Simulation, vol. 43, no. 10-11, pp. 828-837 . https://doi.org/10.1080/08927022.2017.1301665

In recent years, the use of computational tools to aid in the evaluation, understanding and design of advanced porous materials for gas storage and separation processes has become evermore widespread. High-performance computing facilities have become

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e60a8b5058193181722e794e55ef324d
https://doi.org/10.1080/08927022.2017.1301665

Understanding the adsorption process in ZIF-8 using high pressure crystallography and computational modelling

Autor: Tina Düren, Christopher H. Woodall, Carole A. Morrison, Mungo Frost, Konstantin V. Kamenev, Stephen A. Moggach, Matthew J. Lennox, Claire L. Hobday

Publikováno v: Nature Communications
Hobday, C L, Woodall, C H, Lennox, M J, Frost, M, Kamenev, K, Duren, T, Morrison, C A & Moggach, S A 2018, ' Understanding the adsorption process in ZIF-8 using high pressure crystallography and computational modelling ', Nature Communications, vol. 9, 1429 . https://doi.org/10.1038/s41467-018-03878-6
Nature Communications, Vol 9, Iss 1, Pp 1-9 (2018)
Hobday, C, Woodall, C H, Lennox, M J, Frost, M, Kamenev, K, Düren, T, Morrison, C A & Moggach, S A 2018, ' Understanding the adsorption process in ZIF-8 using high pressure crystallography and computational modelling ', Nature Communications, vol. 9, no. 1, 1429 (2018), pp. 1-9 . https://doi.org/10.1038/s41467-018-03878-6

Some porous crystalline solids change their structure upon guest inclusion. Unlocking the potential of these solids for a wide variety of applications requires full characterisation of the response to adsorption and the underlying framework–guest i

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::093b8dc73ced1ab53c4dc6e297938af7

Tailoring Porosity and Rotational Dynamics in a Series of Octacarboxylate Metal-Organic Frameworks

Autor: Timothy L. Easun, Daniil I. Kolokolov, Florian Moreau, Matthew J. Lennox, Harriott Nowell, Elena Besley, Dailly Anne M, Alexander G. Stepanov, Alexander J. Blake, William Lewis, Martin Schröder, Sihai Yang

Publikováno v: Moreau, F, Kolokolov, D I, Stepanov, A G, Easun, T L, Dailly, A, Lewis, W, Blake, A J, Nowell, H, Lennox, M, Besley, E, Yang, S & Schroder, M 2017, ' Tailoring Porosity and Rotational Dynamics in a Series of Octacarboxylate Metal-Organic Frameworks ', Proceedings of the National Academy of Sciences, vol. 114, no. 12, pp. 3056-3061 . https://doi.org/10.1073/pnas.1615172114
Moreau, F, Kolokolov, D I, Stepanov, A G, Easun, T L, Dailly, A, Lewis, W, Blake, A J, Nowell, H, Lennox, M J, Besley, E, Yang, S & Schröder, M 2017, ' Tailoring porosity and rotational dynamics in a series of octacarboxylate metal-organic frameworks ', Proceedings of the National Academy of Sciences of the United States of America, vol. 114, no. 12, pp. 3056-3061 . https://doi.org/10.1073/pnas.1615172114

Modulation and precise control of porosity of metal-organic frameworks (MOFs) is of critical importance to their materials function. Here we report modulation of porosity for a series of isoreticular octacarboxylate MOFs, denoted MFM-180 to MFM-185,

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::70813517813955b3ef7eff7d4f0157b7
https://nottingham-repository.worktribe.com/output/849353/tailoring-porosity-and-rotational-dynamics-in-a-series-of-octacarboxylate-metal-organic-frameworks