-
4
-
-
79956080213
-
2, Ar, Kr and Xe on Activated Carbon and Zeolites: Single Component and Mixture Data
-
2, Ar, Kr and Xe on Activated Carbon and Zeolites: Single Component and Mixture Data Adsorption 2011, 17, 371-383
-
(2011)
Adsorption
, vol.17
, pp. 371-383
-
-
Bazan, R.E.1
Bastos-Neto, M.2
Moeller, A.3
Dreisbach, F.4
Staudt, R.5
-
7
-
-
44649144663
-
4 in Silicalite, C168 Schwarzite, and IRMOF-1: A Comparative Study from Molecular Dynamics Simulation
-
4 in Silicalite, C168 Schwarzite, and IRMOF-1: A Comparative Study from Molecular Dynamics Simulation Langmuir 2008, 24, 5474-5484
-
(2008)
Langmuir
, vol.24
, pp. 5474-5484
-
-
Babarao, R.1
Jiang, J.2
-
9
-
-
1042288187
-
Molecular Dynamics Simulations of Gas Diffusion in Metal-Organic Frameworks: Argon in CuBTC
-
Skoulidas, A. I. Molecular Dynamics Simulations of Gas Diffusion in Metal-Organic Frameworks: Argon in CuBTC J. Am. Chem. Soc. 2004, 126, 1356-1357
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 1356-1357
-
-
Skoulidas, A.I.1
-
10
-
-
65249107223
-
Adsorption and Separation of Noble Gases by IRMOF-1: Grand Canonical Monte Carlo Simulations
-
Greathouse, J. A.; Kinnibrugh, T. L.; Allendorf, M. D. Adsorption and Separation of Noble Gases by IRMOF-1: Grand Canonical Monte Carlo Simulations Ind. Eng. Chem. Res. 2009, 48, 3425-3431
-
(2009)
Ind. Eng. Chem. Res.
, vol.48
, pp. 3425-3431
-
-
Greathouse, J.A.1
Kinnibrugh, T.L.2
Allendorf, M.D.3
-
11
-
-
79958731395
-
Computational Screening of Metal-Organic Frameworks for Xenon/Krypton Separation
-
Ryan, P.; Farha, O. K.; Broadbelt, L. J.; Snurr, R. Q. Computational Screening of Metal-Organic Frameworks for Xenon/Krypton Separation AIChE J. 2011, 57, 1759-1766
-
(2011)
AIChE J.
, vol.57
, pp. 1759-1766
-
-
Ryan, P.1
Farha, O.K.2
Broadbelt, L.J.3
Snurr, R.Q.4
-
12
-
-
84863299996
-
Identification of Metal-Organic Framework Materials for Adsorption Separation of Rare Gases: Applicability of Ideal Adsorbed Solution Theory (IAST) and Effects of Inaccessible Framework Regions
-
Van Heest, T.; Teich-McGoldrick, S. L.; Greathouse, J. A.; Allendorf, M. D.; Sholl, D. S. Identification of Metal-Organic Framework Materials for Adsorption Separation of Rare Gases: Applicability of Ideal Adsorbed Solution Theory (IAST) and Effects of Inaccessible Framework Regions J. Phys. Chem. C 2012, 116, 13183-13195
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 13183-13195
-
-
Van Heest, T.1
Teich-Mcgoldrick, S.L.2
Greathouse, J.A.3
Allendorf, M.D.4
Sholl, D.S.5
-
13
-
-
84862237622
-
Thermodynamic Analysis of Xe/Kr Selectivity in over 137000 Hypothetical Metal-Organic Frameworks
-
Sikora, B. J.; Wilmer, C. E.; Greenfield, M. L.; Snurr, R. Q. Thermodynamic Analysis of Xe/Kr Selectivity in over 137000 Hypothetical Metal-Organic Frameworks Chem. Sci. 2012, 3, 2217-2223
-
(2012)
Chem. Sci.
, vol.3
, pp. 2217-2223
-
-
Sikora, B.J.1
Wilmer, C.E.2
Greenfield, M.L.3
Snurr, R.Q.4
-
14
-
-
84866651180
-
Effects of Polarizability on the Adsorption of Noble Gases at Low Pressures in Monohalogenated Isoreticular Metal-Organic Frameworks
-
Meek, S. T.; Teich-McGoldrick, S. L.; Perry, J. J.; Greathouse, J. A.; Allendorf, M. D. Effects of Polarizability on the Adsorption of Noble Gases at Low Pressures in Monohalogenated Isoreticular Metal-Organic Frameworks J. Phys. Chem. C 2012, 116, 19765-19772
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 19765-19772
-
-
Meek, S.T.1
Teich-Mcgoldrick, S.L.2
Perry, J.J.3
Greathouse, J.A.4
Allendorf, M.D.5
-
15
-
-
33645661036
-
Metal Organic Frameworks-Prospective Industrial Applications
-
Mueller, U.; Schubert, M.; Teich, F.; Puetter, H.; Schierle-Arndt, K.; Pastré, J. Metal Organic Frameworks-Prospective Industrial Applications J. Mater. Chem. 2006, 16, 626-636
-
(2006)
J. Mater. Chem.
, vol.16
, pp. 626-636
-
-
Mueller, U.1
Schubert, M.2
Teich, F.3
Puetter, H.4
Schierle-Arndt, K.5
Pastré, J.6
-
16
-
-
82955186967
-
Facile Xenon Capture and Release at Room Temperature Using a Metal-Organic Framework: A Comparison with Activated Charcoal
-
Thallapally, P. K.; Grate, J. W.; Motkuri, R. K. Facile Xenon Capture and Release at Room Temperature Using a Metal-Organic Framework: A Comparison with Activated Charcoal Chem. Commun. 2012, 48, 347-349
-
(2012)
Chem. Commun.
, vol.48
, pp. 347-349
-
-
Thallapally, P.K.1
Grate, J.W.2
Motkuri, R.K.3
-
17
-
-
84864655436
-
Metal-Organic Frameworks for Removal of Xe and Kr from Nuclear Fuel Reprocessing Plants
-
Liu, J.; Thallapally, P. K.; Strachan, D. Metal-Organic Frameworks for Removal of Xe and Kr from Nuclear Fuel Reprocessing Plants Langmuir 2012, 28, 11584-11589
-
(2012)
Langmuir
, vol.28
, pp. 11584-11589
-
-
Liu, J.1
Thallapally, P.K.2
Strachan, D.3
-
18
-
-
84863456348
-
Noble Gases and Microporous Frameworks: From Interaction to Application
-
Soleimani Dorcheh, A.; Denysenko, D.; Volkmer, D.; Donner, W.; Hirscher, M. Noble Gases and Microporous Frameworks: from Interaction to Application Microporous Mesoporous Mater. 2012, 162, 64-68
-
(2012)
Microporous Mesoporous Mater.
, vol.162
, pp. 64-68
-
-
Soleimani Dorcheh, A.1
Denysenko, D.2
Volkmer, D.3
Donner, W.4
Hirscher, M.5
-
19
-
-
84861868756
-
Switching Kr/Xe Selectivity with Temperature in a Metal-Organic Framework
-
Fernandez, C. A.; Liu, J.; Thallapally, P. K.; Strachan, D. M. Switching Kr/Xe Selectivity with Temperature in a Metal-Organic Framework J. Am. Chem. Soc. 2012, 134, 9046-9049
-
(2012)
J. Am. Chem. Soc.
, vol.134
, pp. 9046-9049
-
-
Fernandez, C.A.1
Liu, J.2
Thallapally, P.K.3
Strachan, D.M.4
-
20
-
-
35148835282
-
Screening Metal-Organic Framework Materials for Membrane-Based Methane/Carbon Dioxide Separations
-
Keskin, S.; Sholl, D. S. Screening Metal-Organic Framework Materials for Membrane-Based Methane/Carbon Dioxide Separations J. Phys. Chem. C 2007, 111, 14055-14059
-
(2007)
J. Phys. Chem. C
, vol.111
, pp. 14055-14059
-
-
Keskin, S.1
Sholl, D.S.2
-
21
-
-
84864704193
-
Atomically Detailed Modeling of Metal Organic Frameworks for Adsorption, Diffusion, and Separation of Noble Gas Mixtures
-
Gurdal, Y.; Keskin, S. Atomically Detailed Modeling of Metal Organic Frameworks for Adsorption, Diffusion, and Separation of Noble Gas Mixtures Ind. Eng. Chem. Res. 2012, 51, 7373-7382
-
(2012)
Ind. Eng. Chem. Res.
, vol.51
, pp. 7373-7382
-
-
Gurdal, Y.1
Keskin, S.2
-
23
-
-
84864247741
-
Understanding the Potential of Zeolite Imidazolate Framework Membranes in Gas Separations Using Atomically Detailed Calculations
-
Atci, E.; Keskin, S. Understanding the Potential of Zeolite Imidazolate Framework Membranes in Gas Separations Using Atomically Detailed Calculations J. Phys. Chem. C 2012, 116, 15525-15537
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 15525-15537
-
-
Atci, E.1
Keskin, S.2
-
24
-
-
84856000753
-
2 Mixtures in Covalent Organic Frameworks: Molecular Simulations and Theoretical Predictions
-
2 Mixtures in Covalent Organic Frameworks: Molecular Simulations and Theoretical Predictions J. Phys. Chem. C 2011, 116, 1772-1779
-
(2011)
J. Phys. Chem. C
, vol.116
, pp. 1772-1779
-
-
Keskin, S.1
-
25
-
-
0001381602
-
Diffusion of Binary Mixtures in Zeolites: Molecular Dynamics Simulations Versus Maxwell-Stefan Theory
-
Krishna, R. Diffusion of Binary Mixtures in Zeolites: Molecular Dynamics Simulations Versus Maxwell-Stefan Theory Chem. Phys. Lett. 2000, 326, 477-484
-
(2000)
Chem. Phys. Lett.
, vol.326
, pp. 477-484
-
-
Krishna, R.1
-
26
-
-
77954215429
-
Highlighting a Variety of Unusual Characteristics of Adsorption and Diffusion in Microporous Materials Induced by Clustering of Guest Molecules
-
Krishna, R.; van Baten, J. M. Highlighting a Variety of Unusual Characteristics of Adsorption and Diffusion in Microporous Materials Induced by Clustering of Guest Molecules Langmuir 2010, 26, 8450-8463
-
(2010)
Langmuir
, vol.26
, pp. 8450-8463
-
-
Krishna, R.1
Van Baten, J.M.2
-
27
-
-
0037127013
-
Systematic Design of Pore Size and Functionality in Isoreticular MOFs and Their Application in Methane Storage
-
Eddaoudi, M.; Kim, J.; Rosi, N.; Vodak, D.; Wachter, J.; O'Keeffe, M.; Yaghi, O. M. Systematic Design of Pore Size and Functionality in Isoreticular MOFs and Their Application in Methane Storage Science 2002, 295, 469-472
-
(2002)
Science
, vol.295
, pp. 469-472
-
-
Eddaoudi, M.1
Kim, J.2
Rosi, N.3
Vodak, D.4
Wachter, J.5
O'Keeffe, M.6
Yaghi, O.M.7
-
28
-
-
33745900775
-
Exceptional Chemical and Thermal Stability of Zeolitic Imidazolate Frameworks
-
Park, K. S.; Ni, Z.; Cote, A. P.; Choi, J. Y.; Huang, R. D.; Uribe-Romo, F. J.; Chae, H. K.; O'Keeffe, M.; Yaghi, O. M. Exceptional Chemical and Thermal Stability of Zeolitic Imidazolate Frameworks Proc. Natl. Acad. Sci. U.S.A. 2006, 103, 10186-10191
-
(2006)
Proc. Natl. Acad. Sci. U.S.A.
, vol.103
, pp. 10186-10191
-
-
Park, K.S.1
Ni, Z.2
Cote, A.P.3
Choi, J.Y.4
Huang, R.D.5
Uribe-Romo, F.J.6
Chae, H.K.7
O'Keeffe, M.8
Yaghi, O.M.9
-
29
-
-
75449104346
-
Synthesis, Structure, and Carbon Dioxide Capture Properties of Zeolitic Imidazolate Frameworks
-
Phan, A.; Doonan, C. J.; Uribe-Romo, F. J.; Knobler, C. B.; O'Keeffe, M.; Yaghi, O. M. Synthesis, Structure, and Carbon Dioxide Capture Properties of Zeolitic Imidazolate Frameworks Acc. Chem. Res. 2010, 43, 58-67
-
(2010)
Acc. Chem. Res.
, vol.43
, pp. 58-67
-
-
Phan, A.1
Doonan, C.J.2
Uribe-Romo, F.J.3
Knobler, C.B.4
O'Keeffe, M.5
Yaghi, O.M.6
-
30
-
-
40549131603
-
0.5]
-
0.5] J. Phys. Chem. C 2008, 112, 2911-2917
-
(2008)
J. Phys. Chem. C
, vol.112
, pp. 2911-2917
-
-
Liu, J.1
Lee, J.Y.2
Pan, L.3
Obermyer, R.T.4
Simizu, S.5
Zande, B.6
Li, J.7
Sankar, S.G.8
Johnson, J.K.9
-
31
-
-
33244456110
-
Hydrogen Adsorption in a Nickel Based Coordination Polymer with Open Metal Sites in the Cylindrical Cavities of the Desolvated Framework
-
Dietzel, P. D. C.; Panella, B.; Hirscher, M.; Blom, R.; Fjellvag, H. Hydrogen Adsorption in a Nickel Based Coordination Polymer with Open Metal Sites in the Cylindrical Cavities of the Desolvated Framework Chem. Commun. 2006, 959-961
-
(2006)
Chem. Commun.
, pp. 959-961
-
-
Dietzel, P.D.C.1
Panella, B.2
Hirscher, M.3
Blom, R.4
Fjellvag, H.5
-
32
-
-
13444267405
-
Rod Packings and Metal-Organic Frameworks Constructed from Rod-Shaped Secondary Building Units
-
Rosi, N. L.; Kim, J.; Eddaoudi, M.; Chen, B. L.; O'Keeffe, M.; Yaghi, O. M. Rod Packings and Metal-Organic Frameworks Constructed from Rod-Shaped Secondary Building Units J. Am. Chem. Soc. 2005, 127, 1504-1518
-
(2005)
J. Am. Chem. Soc.
, vol.127
, pp. 1504-1518
-
-
Rosi, N.L.1
Kim, J.2
Eddaoudi, M.3
Chen, B.L.4
O'Keeffe, M.5
Yaghi, O.M.6
-
33
-
-
74849111475
-
2 Uptake in a Cobalt Adeninate Metal-Organic Framework Exhibiting Pyrimidine- and Amino-Decorated Pores
-
2 Uptake in a Cobalt Adeninate Metal-Organic Framework Exhibiting Pyrimidine- and Amino-Decorated Pores J. Am. Chem. Soc. 2010, 132, 38-39
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 38-39
-
-
An, J.1
Geib, S.J.2
Rosi, N.L.3
-
35
-
-
84859602538
-
Self-Diffusion of Chain Molecules in the Metal-Organic Framework IRMOF-1: Simulation and Experiment
-
Ford, D. C.; Dubbeldam, D.; Snurr, R. Q.; Künzel, V.; Wehring, M.; Stallmach, F.; Kärger, J.; Müller, U. Self-Diffusion of Chain Molecules in the Metal-Organic Framework IRMOF-1: Simulation and Experiment J. Phys. Chem. Lett. 2012, 3, 930-933
-
(2012)
J. Phys. Chem. Lett.
, vol.3
, pp. 930-933
-
-
Ford, D.C.1
Dubbeldam, D.2
Snurr, R.Q.3
Künzel, V.4
Wehring, M.5
Stallmach, F.6
Kärger, J.7
Müller, U.8
-
36
-
-
0031210560
-
Molecular Simulations and NMR Measurements of Binary Diffusion in Zeolites
-
Snurr, R. Q.; Karger, J. Molecular Simulations and NMR Measurements of Binary Diffusion in Zeolites J. Phys. Chem. B 1997, 101, 6469-6473
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 6469-6473
-
-
Snurr, R.Q.1
Karger, J.2
-
38
-
-
9144240095
-
Dreiding: A Generic Force Field for Molecular Simulations
-
Mayo, S. L.; Olafson, B. D.; Goddard, W. A. Dreiding: A Generic Force Field for Molecular Simulations J. Phys. Chem. C 1990, 94, 8897-8909
-
(1990)
J. Phys. Chem. C
, vol.94
, pp. 8897-8909
-
-
Mayo, S.L.1
Olafson, B.D.2
Goddard, W.A.3
-
39
-
-
0042041206
-
Full Periodic Table Force Field for Molecular Mechanics and Molecular Dynamics Simulations
-
Rappe, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A.; Skiff, W. M.; UFF, A. Full Periodic Table Force Field for Molecular Mechanics and Molecular Dynamics Simulations J. Am. Chem. Soc. 1992, 114, 10024-10035
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 10024-10035
-
-
Rappe, A.K.1
Casewit, C.J.2
Colwell, K.S.3
Goddard, W.A.4
Skiff, W.M.5
Uff, A.6
-
43
-
-
0036012759
-
Self-Diffusivities in Multicomponent Mixtures in Zeolites
-
Krishna, R.; Paschek, D. Self-Diffusivities in Multicomponent Mixtures in Zeolites Phys. Chem. Chem. Phys. 2002, 4, 1891-1898
-
(2002)
Phys. Chem. Chem. Phys.
, vol.4
, pp. 1891-1898
-
-
Krishna, R.1
Paschek, D.2
-
46
-
-
0034306372
-
Predicting Single-Component Permeance through Macroscopic Zeolite Membranes from Atomistic Simulations
-
Sholl, D. S. Predicting Single-Component Permeance through Macroscopic Zeolite Membranes from Atomistic Simulations Ind. Eng. Chem. Res. 2000, 39, 3737-3746
-
(2000)
Ind. Eng. Chem. Res.
, vol.39
, pp. 3737-3746
-
-
Sholl, D.S.1
-
47
-
-
0141508849
-
4 Mixtures in MFI Zeolite. A Study Linking MD Simulations with the Maxwell-Stefan Formulation
-
4 Mixtures in MFI Zeolite. A Study Linking MD Simulations with the Maxwell-Stefan Formulation Langmuir 2003, 19, 7977-7988
-
(2003)
Langmuir
, vol.19
, pp. 7977-7988
-
-
Skoulidas, A.I.1
Sholl, D.S.2
Krishna, R.3
-
48
-
-
3342922327
-
Thermodynamics of Mixed-Gas Adsorption
-
Myers, A. L.; Prausnitz, J. M. Thermodynamics of Mixed-Gas Adsorption AIChE J. 1965, 11, 121-127
-
(1965)
AIChE J.
, vol.11
, pp. 121-127
-
-
Myers, A.L.1
Prausnitz, J.M.2
-
49
-
-
79251605978
-
Ethene/Ethane Separation by the MOF Membrane ZIF-8: Molecular Correlation of Permeation, Adsorption, Diffusion
-
Bux, H.; Chmelik, C.; Krishna, R.; Caro, J. Ethene/Ethane Separation by the MOF Membrane ZIF-8: Molecular Correlation of Permeation, Adsorption, Diffusion J. Membr. Sci. 2011, 369, 284-289
-
(2011)
J. Membr. Sci.
, vol.369
, pp. 284-289
-
-
Bux, H.1
Chmelik, C.2
Krishna, R.3
Caro, J.4
-
50
-
-
66249084513
-
2 Separation in Zeolites and Metal-Organic Frameworks
-
2 Separation in Zeolites and Metal-Organic Frameworks Langmuir 2009, 25, 5918-5926
-
(2009)
Langmuir
, vol.25
, pp. 5918-5926
-
-
Liu, B.1
Smit, B.2
-
51
-
-
84860513982
-
2 Selectivity in Metal-Organic Frameworks Using Monte Carlo Simulations and Ideal Adsorbed Solution Theory
-
2 Selectivity in Metal-Organic Frameworks Using Monte Carlo Simulations and Ideal Adsorbed Solution Theory Can. J. Chem. Eng. 2012, 90, 825-832
-
(2012)
Can. J. Chem. Eng.
, vol.90
, pp. 825-832
-
-
Dickey, A.N.1
Yazaydin, A.O.2
Willis, R.R.3
Snurr, R.Q.4
-
52
-
-
70349925710
-
Efficient Methods for Screening of Metal Organic Framework Membranes for Gas Separations Using Atomically Detailed Models
-
Keskin, S.; Sholl, D. S. Efficient Methods for Screening of Metal Organic Framework Membranes for Gas Separations Using Atomically Detailed Models Langmuir 2009, 25, 11786-11795
-
(2009)
Langmuir
, vol.25
, pp. 11786-11795
-
-
Keskin, S.1
Sholl, D.S.2
-
54
-
-
82455219362
-
Development and Evaluation of Porous Materials for Carbon Dioxide Separation and Capture
-
Bae, Y.-S.; Snurr, R. Q. Development and Evaluation of Porous Materials for Carbon Dioxide Separation and Capture Angew. Chem., Int. Ed. 2011, 50, 11586-11596
-
(2011)
Angew. Chem., Int. Ed.
, vol.50
, pp. 11586-11596
-
-
Bae, Y.-S.1
Snurr, R.Q.2
-
55
-
-
0002365946
-
NMR Self-Diffusion Studies in Zeolite Science and Technology
-
Karger, J.; Pfeifer, H. NMR Self-Diffusion Studies in Zeolite Science and Technology Zeolites 1987, 7, 90-107
-
(1987)
Zeolites
, vol.7
, pp. 90-107
-
-
Karger, J.1
Pfeifer, H.2
-
56
-
-
33646380339
-
Testing Predictions of Macroscopic Binary Diffusion Coefficients Using Lattice Models with Site Heterogeneity
-
Sholl, D. S. Testing Predictions of Macroscopic Binary Diffusion Coefficients Using Lattice Models with Site Heterogeneity Langmuir 2006, 22, 3707-3714
-
(2006)
Langmuir
, vol.22
, pp. 3707-3714
-
-
Sholl, D.S.1
-
57
-
-
0000483851
-
Inter-Relation between Self- and Jump-Diffusivities in Zeolites
-
Paschek, D.; Krishna, R. Inter-Relation between Self- and Jump-Diffusivities in Zeolites Chem. Phys. Lett. 2001, 333, 278-284
-
(2001)
Chem. Phys. Lett.
, vol.333
, pp. 278-284
-
-
Paschek, D.1
Krishna, R.2
-
58
-
-
33749683984
-
Molecular Simulation of Carbon Dioxide/Methane/Hydrogen Mixture Adsorption in Metal-Organic Frameworks
-
Yang, Q.; Zhong, C. Molecular Simulation of Carbon Dioxide/Methane/ Hydrogen Mixture Adsorption in Metal-Organic Frameworks J. Phys. Chem. B 2006, 110, 17776-17783
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 17776-17783
-
-
Yang, Q.1
Zhong, C.2
-
59
-
-
0347292989
-
-
Auerbach, S. M. Carrado, K. Dutta, P. Marcel Dekker: New York
-
Izumi, J. In Handbook of Zeolite Science and Technology; Auerbach, S. M.; Carrado, K.; Dutta, P., Eds.; Marcel Dekker: New York, 2003.
-
(2003)
Handbook of Zeolite Science and Technology
-
-
Izumi, J.1
-
60
-
-
0000026514
-
Competitive Adsorption of Xenon and Krypton in Zeolite Naa: Xe-129 Nuclear Magnetic Resonance Studies and Grand Canonical Monte Carlo Simulations
-
Jameson, C. J.; Jameson, A. K.; Lim, H. M. Competitive Adsorption of Xenon and Krypton in Zeolite Naa: Xe-129 Nuclear Magnetic Resonance Studies and Grand Canonical Monte Carlo Simulations J. Chem. Phys. 1997, 107, 4364-4372
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 4364-4372
-
-
Jameson, C.J.1
Jameson, A.K.2
Lim, H.M.3
|