Density functional theory methods for characterization of porous materials

J Landers, GY Gor, AV Neimark - Colloids and Surfaces A: Physicochemical …, 2013 - Elsevier
This review presents the state-of-the-art of adsorption characterization of mesoporous and
microporous materials by using the density functional theory (DFT) methods. The DFT …

Water as an active constituent in cell biology

P Ball - Chemical reviews, 2008 - ACS Publications
When Szent-Györgyi called water the “matrix of life”, 1 he was echoing an old sentiment.
Paracelsus in the 16th century said that “water was the matrix of the world and of all its …

Effect of capillary pressure on phase behavior in tight rocks and shales

B Nojabaei, RTT Johns, L Chu - SPE Reservoir Evaluation & …, 2013 - onepetro.org
Phase behavior is important in the calculation of hydrocarbons in place and in the flow of
phases through the rocks. Pore sizes can be on the order of nanometers for shale and tight …

Physisorption hysteresis loops and the characterization of nanoporous materials

KSW Sing, RT Williams - Adsorption Science & Technology, 2004 - journals.sagepub.com
The classification of adsorption hysteresis loops recommended by the IUPAC in 1984 was
based on experimental observations and the application of classical principles of pore filling …

A new analysis method for the determination of the pore size distribution of porous carbons from nitrogen adsorption measurements

NA Seaton, J Walton - Carbon, 1989 - Elsevier
A new analysis method has been developed for the determination of the pore size
distribution of porous carbons from nitrogen adsorption measurements. The method is …

A review on capillary condensation in nanoporous media: Implications for hydrocarbon recovery from tight reservoirs

E Barsotti, SP Tan, S Saraji, M Piri, JH Chen - Fuel, 2016 - Elsevier
The key to understanding capillary condensation phenomena and employing that
knowledge in a wide range of engineering applications lies in the synergy of theoretical and …

Understanding adsorption/desorption hysteresis for fluids in mesoporous materials using simple molecular models and classical density functional theory

PA Monson - Microporous and Mesoporous Materials, 2012 - Elsevier
In this tutorial review, we discuss the use of classical density functional theory (DFT) to
understand adsorption/desorption hysteresis phenomena for fluids confined in mesoporous …

Adsorption and capillary condensation in porous media: Liquid retention and interfacial configurations in angular pores

M Tuller, D Or, LM Dudley - Water resources research, 1999 - Wiley Online Library
Conventional models of liquid distribution, flow, and solute transport in partially saturated
porous media are limited by the representation of media pore space as a bundle of …

Thermodynamic modeling of phase behavior in shale media

Z Jin, A Firoozabadi - Spe Journal, 2016 - onepetro.org
In conventional permeable media, once pore volume (PV) is known, the amount of fluid-in-
place can be estimated. This is because the fluid is locally homogeneous, pores are …

Quasipure Bose-Einstein condensate immersed in a Fermi sea

F Schreck, L Khaykovich, KL Corwin, G Ferrari… - Physical Review Letters, 2001 - APS
We report the observation of coexisting Bose-Einstein condensate (BEC) and Fermi gas in a
magnetic trap. With a very small fraction of thermal atoms, the 7 Li condensate is quasipure …