Zobrazeno 1 - 10
of 10
pro vyhledávání: '"Charanjit S. Paur"'
Autor:
Peter I. Ravikovitch, Tom Willhammar, Terefenko Eugene, Elina Kapaca, Lucas Koziol, Hongyi Xu, Xiaodong Zou, Allen W. Burton, Charanjit S. Paur, Hilda B. Vroman, Mobae Afeworki, Simon C. Weston, Meghan L. Nines Kochersperger
Publikováno v:
Inorganic Chemistry. 58:12854-12858
A new aluminosilicate zeolite, denoted EMM-37, with a 3D small pore channel system, has been synthesized using a diquaternary ammonium molecule as the structure directing agent (SDA) and metakaolin as the aluminum source. The structures of both as-ma
Autor:
David S. Sholl, Alexander S. Hyla, Karl G. Strohmaier, Giovanni Muraro, Salah Eddine Boulfelfel, Hanjun Fang, Peter I. Ravikovitch, Charanjit S. Paur
Publikováno v:
The Journal of Physical Chemistry C. 123:20405-20412
Heat of adsorption is an important factor in determining the utility of a porous material for gas separation and storage applications. Although theoretically the heat of adsorption can depend on temperature, it is common practice to assume that this
Autor:
Charanjit S. Paur, Adeana Richelle Bishop, Pavel Kortunov, Edward W. Corcoran, Chris Yoon, Allen W. Burton, Susana Valencia, Yu Wang, Miguel Palomino, Pablo J. Bereciartua, José L. Jordá, Gary L. Casty, Javier Guzman, Peter I. Ravikovitch, Fernando Rey, Ángel Cantín, Avelino Corma
Publikováno v:
RiuNet. Repositorio Institucional de la Universitat Politécnica de Valéncia
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[EN] The discovery of new materials for separating ethylene from ethane by adsorption, instead of using cryogenic distillation, is a key milestone for molecular separations because of the multiple and widely extended uses of these molecules in indust
Publikováno v:
AIChE Journal. 63:1077-1090
A new pressure-swing frequency response (PSFR) method has been developed to study mass transfer in adsorption systems as a function of temperature and pressure, from -70 to 180 oC, and up to 7 bar. New in-phase and out-of-phase functions have been de
Autor:
Karl G. Strohmaier, Charanjit S. Paur, Hilda B. Vroman, Junliang Sun, Mobae Afeworki, Peng Guo, Allen W. Burton, Peter I. Ravikovitch, Xiaodong Zou
Publikováno v:
Inorganic Chemistry Frontiers. 3:1444-1448
A new borosilicate zeolite |N2H36C16|[Si22B2O48]·H2O, denoted as EMM-26, has been synthesized by employing a linear dicationic organic structure directing agent 1,6-bis(N-methylpyrrolidinium)hexane (OSDA). EMM-26 has a novel zeolite framework and co
Autor:
Charanjit S. Paur, Peter I. Ravikovitch, David S. Sholl, Preeti Kamakoti, Stephen M. Cundy, Hanjun Fang, Ji Zang
Publikováno v:
The Journal of Physical Chemistry C. 116:10692-10701
We demonstrate a new approach to develop transferable force fields describing molecular adsorption in zeolites by combining dispersion-corrected density functional theory (DFT) calculations and classical atomistic simulations. This approach is illust
Autor:
Pavel Kortunov, Peter I. Ravikovitch, Charanjit S. Paur, Yi Du, Simon C. Weston, John Zengel, Bradley Wooler, Meghan Nines
Publikováno v:
Journal of the American Chemical Society. 137(42)
We have found that the 3D zeolitic imidazolate framework ZIF-7 exhibits far more complex behavior in response to the adsorption of guest molecules and changes in temperature than previously thought. We believe that this arises from the existence of d
Autor:
Preeti Kamakoti, David S. Sholl, Matthew Aronson, Charanjit S. Paur, Peter I. Ravikovitch, Hanjun Fang
Publikováno v:
Physical chemistry chemical physics : PCCP. 15(31)
The development of accurate force fields is vital for predicting adsorption in porous materials. Previously, we introduced a first principles-based transferable force field for CO2 adsorption in siliceous zeolites (Fang et al., J. Phys. Chem. C, 2012
Autor:
David C. Calabro, Peter I. Ravikovitch, Yi Du, Preeti Kamakoti, Charanjit S. Paur, Quanchang Li, Kanmi Mao, Stephen M. Cundy
Publikováno v:
Chemical communications (Cambridge, England). 48(38)
Pyridine-modified COF-10 exhibits enhanced stability in humid air relative to un-modified COF-10. Solid state NMR and computational studies were used to probe the nature of pyridine interactions with the framework. We propose two models for pyridine
Publikováno v:
AIP Conference Proceedings.
Zeolitic imidazolate frameworks (ZIFs), a unique subclass of metal‐organic frameworks (MOFs) recently reported by Yaghi group and others, are attracting worldwide attention. Our systematic work on the adsorption and molecular transport in ZIFs has