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Density functional theory methods for characterization of porous materials
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In this paper, the authors present the state-of-the-art of adsorption characterization of mesoporous and microporous materials by using the density functional theory (DFT) methods.About:
This article is published in Colloids and Surfaces A: Physicochemical and Engineering Aspects.The article was published on 2013-11-20. It has received 903 citations till now. The article focuses on the topics: Microporous material & Mesoporous material.read more
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Phd by thesis
TL;DR: In this paper, a sedimentological core and petrographic characterisation of samples from eleven boreholes from the Lower Carboniferous of Bowland Basin (Northwest England) is presented.
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Quantum-mechanical condensed matter simulations with CRYSTAL
Roberto Dovesi,Alessandro Erba,Roberto Orlando,Claudio M. Zicovich-Wilson,Bartolomeo Civalleri,Lorenzo Maschio,Michel Rérat,Silvia Casassa,Jacopo Baima,Simone Salustro,Bernard Kirtman +10 more
TL;DR: The Crystal program as discussed by the authors adopts atom-centered Gaussian-type functions as a basis set, which makes it possible to perform all-electron as well as pseudopotential calculations.
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Porous Organic Materials: Strategic Design and Structure–Function Correlation
TL;DR: This review encompasses the recent significant breakthroughs and the conventional functions and practices in the field of porous Organic materials to find useful applications and imparts a comprehensive understanding of the strategic evolution of the design and synthetic approaches of porous organic materials with tunable characteristics.
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Recent advances in the textural characterization of hierarchically structured nanoporous materials
TL;DR: This review focuses on important aspects of applying physisorption for the pore structural characterization of hierarchical materials such as mesoporous zeolites and strongly emphasizes the importance of combining advanced physical adsorption with other complementary experimental techniques for obtaining a reliable and comprehensive understanding of the texture of hierarchically structured materials.
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Physical adsorption characterization of nanoporous materials: progress and challenges
TL;DR: In this article, the authors discuss important aspects of major underlying mechanisms associated with adsorption, pore condensation and hysteresis behavior in nanoporous solids and discuss selected examples of state-of-the-art pore size characterization.
References
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Adsorption of Gases in Multimolecular Layers
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Ordered mesoporous molecular sieves synthesized by a liquid-crystal template mechanism
TL;DR: In this paper, the synthesis of mesoporous inorganic solids from calcination of aluminosilicate gels in the presence of surfactants is described, in which the silicate material forms inorganic walls between ordered surfactant micelles.
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The Determination of Pore Volume and Area Distributions in Porous Substances. I. Computations from Nitrogen Isotherms
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A new family of mesoporous molecular sieves prepared with liquid crystal templates
Jeffrey S. Beck,James C. Vartuli,Wieslaw J. Roth,M. E. Leonowicz,Charles T. Kresge,Kirk D. Schmitt,Cynthia Ting-Wah Chu,David H. Olson,E. W. Sheppard,S. B. McCullen,J. B. Higgins,J.L. Schlenker +11 more
TL;DR: In this paper, the synthesis, characterization, and proposed mechanism of formation of a new family of silicatelaluminosilicate mesoporous molecular sieves designated as M41S is described.
Journal ArticleDOI
Phd by thesis
TL;DR: In this paper, a sedimentological core and petrographic characterisation of samples from eleven boreholes from the Lower Carboniferous of Bowland Basin (Northwest England) is presented.