-
1
-
-
84863011015
-
Metal-Organic Frameworks for Separations
-
Li, J.; Sculley, J.; Zhou, H.-C. Metal-Organic Frameworks for Separations. Chem. Rev. 2012, 112, 869-932.
-
(2012)
Chem. Rev.
, vol.112
, pp. 869-932
-
-
Li, J.1
Sculley, J.2
Zhou, H.-C.3
-
2
-
-
84859114412
-
Hydrocarbon Separations in a Metal-Organic Framework with Open iron(II) Coordination Sites
-
Bloch, E. D.; Queen, W. L.; Krishna, R.; Zadrozny, J. M.; Brown, C. M.; Long, J. R. Hydrocarbon Separations in a Metal-Organic Framework with Open iron(II) Coordination Sites. Science 2012, 335, 1606-1610.
-
(2012)
Science
, vol.335
, pp. 1606-1610
-
-
Bloch, E.D.1
Queen, W.L.2
Krishna, R.3
Zadrozny, J.M.4
Brown, C.M.5
Long, J.R.6
-
3
-
-
84863011315
-
Commensurate Adsorption of Hydrocarbons and Alcohols in Microporous Metal Organic Frameworks
-
Wu, H.; Gong, Q.; Olson, D. H.; Li, J. Commensurate Adsorption of Hydrocarbons and Alcohols in Microporous Metal Organic Frameworks. Chem. Rev. 2012, 112, 836-868.
-
(2012)
Chem. Rev.
, vol.112
, pp. 836-868
-
-
Wu, H.1
Gong, Q.2
Olson, D.H.3
Li, J.4
-
4
-
-
33645661036
-
Metal-organic Frameworks - Prospective Industrial Applications
-
Mueller, U.; Schubert, M.; Teich, F.; Puetter, H.; Pastre, 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
Pastre, J.5
-
5
-
-
84892562663
-
Hydrocarbon Separations in Metal-Organic Frameworks
-
Herm, Z. R.; Bloch, E. D.; Long, R. Hydrocarbon Separations in Metal-Organic Frameworks. Chem. Mater. 2014, 26, 323-338.
-
(2014)
Chem. Mater.
, vol.26
, pp. 323-338
-
-
Herm, Z.R.1
Bloch, E.D.2
Long, R.3
-
6
-
-
55649095754
-
Cage and Window Effects in the Adsorption of N-Alkanes on Chabazite and SAPO-34
-
Denayer, J. F. M.; Devriese, L. I.; Couck, S.; Martens, J.; Singh, R.; Webley, P. A.; Baron, G. V. Cage and Window Effects in the Adsorption of N-Alkanes on Chabazite and SAPO-34. J. Phys. Chem. C 2008, 112, 16593-16599.
-
(2008)
J. Phys. Chem. C
, vol.112
, pp. 16593-16599
-
-
Denayer, J.F.M.1
Devriese, L.I.2
Couck, S.3
Martens, J.4
Singh, R.5
Webley, P.A.6
Baron, G.V.7
-
7
-
-
33749233586
-
Adsorption and Separation of Linear and Branched Alkanes on Carbon Nanotube Bundles from Configurational-Bias Monte Carlo Simulation
-
Jiang, J.; Sandler, S. I.; Schenk, M.; Smit, B. Adsorption and Separation of Linear and Branched Alkanes on Carbon Nanotube Bundles from Configurational-Bias Monte Carlo Simulation. Phys. Rev. B 2005, 72, 045447-1-045447-11.
-
(2005)
Phys. Rev. B
, vol.72
, pp. 0454471-04544711
-
-
Jiang, J.1
Sandler, S.I.2
Schenk, M.3
Smit, B.4
-
8
-
-
26844473334
-
Diffusion in Confined Systems: Methane in a ZK4Molecular Sieve. A Molecular Dynamics Simulation Study
-
Demontis, P.; Fenu, L. A. A.; Suffritti, G. B. B. Diffusion in Confined Systems: Methane in a ZK4Molecular Sieve. A Molecular Dynamics Simulation Study. J. Phys. Chem. B 2005, 108, 18081-18087.
-
(2005)
J. Phys. Chem. B
, vol.108
, pp. 18081-18087
-
-
Demontis, P.1
Fenu, L.A.A.2
Suffritti, G.B.B.3
-
9
-
-
0034813853
-
Statics and Dynamics of Ethane Molecules in AlPO4-5: A Molecular Dynamics Simulations Study
-
Demontis, P.; Gonzalez, J. G.; Suffritti, G. B. Statics and Dynamics of Ethane Molecules in AlPO4-5: A Molecular Dynamics Simulations Study. J. Am. Chem. Soc. 2001, 123, 5069-5074.
-
(2001)
J. Am. Chem. Soc.
, vol.123
, pp. 5069-5074
-
-
Demontis, P.1
Gonzalez, J.G.2
Suffritti, G.B.3
-
10
-
-
0001693970
-
Structure and Dynamics of Zeolites Investigated by Molecular Dynamics
-
Demontis, P.; Suffritti, G. B. Structure and Dynamics of Zeolites Investigated by Molecular Dynamics. Chem. Rev. 1997, 97, 2845-2878.
-
(1997)
Chem. Rev.
, vol.97
, pp. 2845-2878
-
-
Demontis, P.1
Suffritti, G.B.2
-
11
-
-
0000489270
-
A Molecular Dynamics Study of Diffusion of Methane in Partially Dealuminated Zeolite NaA
-
Demontis, P.; Suffritti, G. B.. A Molecular Dynamics Study of Diffusion of Methane in Partially Dealuminated Zeolite NaA. Mol. Phys. 1997, 91, 669-679.
-
(1997)
Mol. Phys.
, vol.91
, pp. 669-679
-
-
Demontis, P.1
Suffritti, G.B.2
-
12
-
-
33751234937
-
Loading Dependence of the Diffusion Coefficient of Methane in Nanoporous Materials
-
Beerdsen, E.; Dubbeldam, D.; Smit, B. Loading Dependence of the Diffusion Coefficient of Methane in Nanoporous Materials. J. Phys. Chem. B 2006, 110, 22754-22772.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 22754-22772
-
-
Beerdsen, E.1
Dubbeldam, D.2
Smit, B.3
-
13
-
-
33144485459
-
Understanding Diffusion in Nanoporous Materials
-
Beerdsen, E.; Dubbeldam, D.; Smit, B. Understanding Diffusion in Nanoporous Materials. Phys. Rev. Lett. 2006, 96, 044501.
-
(2006)
Phys. Rev. Lett.
, vol.96
, pp. 044501
-
-
Beerdsen, E.1
Dubbeldam, D.2
Smit, B.3
-
14
-
-
42749109098
-
Molecular Simulation of Loading Dependent Slow Diffusion in Confined Systems
-
Beerdsen, E.; Smit, B.; Dubbeldam, D. Molecular Simulation of Loading Dependent Slow Diffusion in Confined Systems. Phys. Rev. Lett. 2004, 93, 248301.
-
(2004)
Phys. Rev. Lett.
, vol.93
, pp. 248301
-
-
Beerdsen, E.1
Smit, B.2
Dubbeldam, D.3
-
15
-
-
77957874860
-
Modeling Adsorption and Self-Diffusion of Methane in LTA Zeolites: The Influence of Framework Flexibility
-
Garcia-Sanchez, A.; Dubbeldam, D.; Calero, S. Modeling Adsorption and Self-Diffusion of Methane in LTA Zeolites: The Influence of Framework Flexibility. J. Phys. Chem. C 2010, 114, 15068-15074.
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 15068-15074
-
-
Garcia-Sanchez, A.1
Dubbeldam, D.2
Calero, S.3
-
16
-
-
33845679024
-
A Molecular Dynamic Investigation of the Diffusion of Methane-Ethane and Methane-Propane Mixtures in Zeolites
-
Krishna, R.; van Baten, J. M. A Molecular Dynamic Investigation of the Diffusion of Methane-Ethane and Methane-Propane Mixtures in Zeolites. Chem. Eng. Technol. 2006, 29, 1429-1437.
-
(2006)
Chem. Eng. Technol.
, vol.29
, pp. 1429-1437
-
-
Krishna, R.1
Van Baten, J.M.2
-
17
-
-
67349284939
-
A Molecular Simulation Study of Commensurate-incommensurate Adsorption of N-Alkanes in Cobalt Formate Frameworks
-
Krishna, R.; van Baten, J. M. A Molecular Simulation Study of Commensurate-incommensurate Adsorption of N-Alkanes in Cobalt Formate Frameworks. Mol. Simul. 2009, 35, 1098-1104.
-
(2009)
Mol. Simul.
, vol.35
, pp. 1098-1104
-
-
Krishna, R.1
Van Baten, J.M.2
-
18
-
-
0000313882
-
Temperature and Concentration Dependence of Adsorption Properties of Methane in Nay: A Molecular Dynamics Study
-
Yashonath, S.; Demontis, P.; Klein, M. L. Temperature and Concentration Dependence of Adsorption Properties of Methane in Nay: A Molecular Dynamics Study. J. Phys. Chem. 1991, 95, 5881-5889.
-
(1991)
J. Phys. Chem.
, vol.95
, pp. 5881-5889
-
-
Yashonath, S.1
Demontis, P.2
Klein, M.L.3
-
19
-
-
0037448263
-
Diffusion of Propane in Zeolite NaY: A Molecular Dynamics and Quasi-Elastic Neutron Scattering Study
-
Sayeed, A.; Mitra, S.; Anil Kumar, a. V.; Mukhopadhyay, R.; Yashonath, S.; Chaplot, S. L. Diffusion of Propane in Zeolite NaY: A Molecular Dynamics and Quasi-Elastic Neutron Scattering Study. J. Phys. Chem. B 2003, 107, 527-533.
-
(2003)
J. Phys. Chem. B
, vol.107
, pp. 527-533
-
-
Sayeed, A.1
Mitra, S.2
Anil Kumar, A.V.3
Mukhopadhyay, R.4
Yashonath, S.5
Chaplot, S.L.6
-
20
-
-
0000695403
-
Diffusion Mechanisms of Normal Alkanes in Faujasite Zeolites
-
Clark, L. A.; Ye, G. T.; Gupta, A.; Hall, L. L.; Snurr, R. Q. Diffusion Mechanisms of Normal Alkanes in Faujasite Zeolites. J. Chem. Phys. 1999, 111, 1209-1222.
-
(1999)
J. Chem. Phys.
, vol.111
, pp. 1209-1222
-
-
Clark, L.A.1
Ye, G.T.2
Gupta, A.3
Hall, L.L.4
Snurr, R.Q.5
-
21
-
-
77949833948
-
Diffusion of Pure CH 4 and Its Binary Mixture with CO 2 in Faujasite NaY: A Combination of Neutron Scattering Experiments and Molecular Dynamics Simulations
-
Deroche, I.; Maurin, G.; Borah, B. J.; Yashonath, S.; Jobic, H. Diffusion of Pure CH 4 and Its Binary Mixture with CO 2 in Faujasite NaY: A Combination of Neutron Scattering Experiments and Molecular Dynamics Simulations. J. Phys. Chem. C 2010, 114, 5027-5034.
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 5027-5034
-
-
Deroche, I.1
Maurin, G.2
Borah, B.J.3
Yashonath, S.4
Jobic, H.5
-
22
-
-
4444372564
-
Non-Equilibrium Molecular Dynamics Simulations of Diffusion of Binary Mixtures Containing Short N-Alkanes in Faujasite
-
Chempath, S.; Krishna, R.; Snurr, R. Q. Non-Equilibrium Molecular Dynamics Simulations of Diffusion of Binary Mixtures Containing Short N-Alkanes in Faujasite. J. Phys. Chem. B 2004, 108, 13481-13491.
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 13481-13491
-
-
Chempath, S.1
Krishna, R.2
Snurr, R.Q.3
-
23
-
-
84879812170
-
Diffusion of CH4, CO2, and Their Mixtures in AlPO4-5 Investigated by QENSExperiments and MD Simulations
-
Rives, S.; Jobic, H.; Beale, A. M.; Maurin, G. Diffusion of CH4, CO2, and Their Mixtures in AlPO4-5 Investigated by QENSExperiments and MD Simulations. J. Phys. Chem. C 2013, 117, 13530-13539.
-
(2013)
J. Phys. Chem. C
, vol.117
, pp. 13530-13539
-
-
Rives, S.1
Jobic, H.2
Beale, A.M.3
Maurin, G.4
-
24
-
-
25444520506
-
Molecular Dynamics Simulations of the Adsorption and Diffusion Behavior of Pure and Mixed Alkanes in Silicalite
-
Hussain, I.; Titiloye, J. O. Molecular Dynamics Simulations of the Adsorption and Diffusion Behavior of Pure and Mixed Alkanes in Silicalite. Microporous Mesoporous Mater. 2005, 85, 143-156.
-
(2005)
Microporous Mesoporous Mater.
, vol.85
, pp. 143-156
-
-
Hussain, I.1
Titiloye, J.O.2
-
25
-
-
0031272651
-
Adsorption and Transport of Ethane and Ethene in Zeolite NaA: 2 H NMR and Monte Carlo Lattice Dynamics Studies
-
Gladden, L. F.; Sousa-Goncalves, J. A.; Alexander, P. Adsorption and Transport of Ethane and Ethene in Zeolite NaA: 2 H NMR and Monte Carlo Lattice Dynamics Studies. J. Phys. Chem. B 1997, 101, 10121-10127.
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 10121-10127
-
-
Gladden, L.F.1
Sousa-Goncalves, J.A.2
Alexander, P.3
-
26
-
-
20544435423
-
Molecular Simulation of Loading-Dependent Diffusion in Nanoporous Materials Using Extended Dynamically Corrected Transition State Theory
-
Dubbeldam, D.; Beerdsen, E.; Vlugt, T. J. H.; Smit, B. Molecular Simulation of Loading-Dependent Diffusion in Nanoporous Materials Using Extended Dynamically Corrected Transition State Theory. J. Chem. Phys. 2005, 122, 224712.
-
(2005)
J. Chem. Phys.
, vol.122
, pp. 224712
-
-
Dubbeldam, D.1
Beerdsen, E.2
Vlugt, T.J.H.3
Smit, B.4
-
27
-
-
32644449148
-
PFG NMR and QENS Diffusion Study of N-Alkane Homologues in MFI-Type Zeolites
-
Jobic, H.; Schmidt, W.; Krause, C. B.; Karger, J. PFG NMR and QENS Diffusion Study of N-Alkane Homologues in MFI-Type Zeolites. Microporous Mesoporous Mater. 2006, 90, 299-306.
-
(2006)
Microporous Mesoporous Mater.
, vol.90
, pp. 299-306
-
-
Jobic, H.1
Schmidt, W.2
Krause, C.B.3
Karger, J.4
-
28
-
-
84880869241
-
A Diffusion Study of Small Hydrocarbons in DDR Zeolites by Micro-Imaging
-
Binder, T.; Chmelik, C.; Kärger, J.; Martinez-Joaristi, A.; Gascon, J.; Kapteijn, F.; Ruthven, D. A Diffusion Study of Small Hydrocarbons in DDR Zeolites by Micro-Imaging. Microporous Mesoporous Mater. 2013, 180, 219-228.
-
(2013)
Microporous Mesoporous Mater.
, vol.180
, pp. 219-228
-
-
Binder, T.1
Chmelik, C.2
Kärger, J.3
Martinez-Joaristi, A.4
Gascon, J.5
Kapteijn, F.6
Ruthven, D.7
-
29
-
-
34247174074
-
Quasi-Elastic Neutron Scattering and Molecular Dynamics Simulation as Complementary Techniques for Studying Diffusion in Zeolites
-
Jobic, H.; Theodorou, D. N. Quasi-Elastic Neutron Scattering and Molecular Dynamics Simulation as Complementary Techniques for Studying Diffusion in Zeolites. Microporous Mesoporous Mater. 2007, 102, 21-50.
-
(2007)
Microporous Mesoporous Mater.
, vol.102
, pp. 21-50
-
-
Jobic, H.1
Theodorou, D.N.2
-
30
-
-
0031187045
-
Unidirectional and Single-File Diffusion of Molecules in One-Dimensional Channel Systems: A Quasi-Elastic Neutron Scattering Study
-
Jobic, H.; Hahn, K.; Karger, J.; Bee, M.; Tuel, A.; Noack, M.; Gimus, I.; Kearley, G. J. Unidirectional and Single-File Diffusion of Molecules in One-Dimensional Channel Systems: A Quasi-Elastic Neutron Scattering Study. J. Phys. Chem. B 1997, 101, 5834-5841.
-
(1997)
J. Phys. Chem. B
, vol.101
, pp. 5834-5841
-
-
Jobic, H.1
Hahn, K.2
Karger, J.3
Bee, M.4
Tuel, A.5
Noack, M.6
Gimus, I.7
Kearley, G.J.8
-
31
-
-
18844400657
-
Concentration Dependence of Transport Diffusion of Ethane in Silicalite: A Comparison between Neutron Scattering Experiments and Atomically Detailed Simulations
-
Chong, S. S.; Jobic, H.; Plazanet, M.; Sholl, D. S. Concentration Dependence of Transport Diffusion of Ethane in Silicalite: A Comparison between Neutron Scattering Experiments and Atomically Detailed Simulations. Chem. Phys. Lett. 2005, 408, 157-161.
-
(2005)
Chem. Phys. Lett.
, vol.408
, pp. 157-161
-
-
Chong, S.S.1
Jobic, H.2
Plazanet, M.3
Sholl, D.S.4
-
32
-
-
0037119638
-
On the Jump Diffusion of Molecules in Zeolites Measured by Quasi-Elastic Neutron Scattering
-
Jobic, H. On the Jump Diffusion of Molecules in Zeolites Measured by Quasi-Elastic Neutron Scattering. Microporous Mesoporous Mater. 2002, 55, 159-169.
-
(2002)
Microporous Mesoporous Mater.
, vol.55
, pp. 159-169
-
-
Jobic, H.1
-
33
-
-
0033686722
-
Dynamics of N-Butane-Methane Mixtures in Silicalite, Using Quasielastic Neutron Scattering and Molecular Dynamics Simulations
-
Gergidis, L. N.; Theodorou, D. N.; Jobic, H. Dynamics of N-Butane-Methane Mixtures in Silicalite, Using Quasielastic Neutron Scattering and Molecular Dynamics Simulations. J. Phys. Chem. B 2000, 104, 5541-5552.
-
(2000)
J. Phys. Chem. B
, vol.104
, pp. 5541-5552
-
-
Gergidis, L.N.1
Theodorou, D.N.2
Jobic, H.3
-
34
-
-
0001517676
-
Mobility of Methane in Zeolite NaY between 100 and 250K - A Quasi-Elastic Neutron-Scattering Study
-
Jobic, H.; Bee, M.; Kearley, G. J. Mobility of Methane in Zeolite NaY between 100 and 250K - A Quasi-Elastic Neutron-Scattering Study. J. Phys. Chem. 1994, 98, 4660-4665.
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 4660-4665
-
-
Jobic, H.1
Bee, M.2
Kearley, G.J.3
-
35
-
-
0026818337
-
Dynamics of Ethane and Propane in Zeolite ZSM-5 Studied by Quasi-Elastic Neutron-Scattering
-
Jobic, H.; Bee, M.; Kearley, G. J. Dynamics of Ethane and Propane in Zeolite ZSM-5 Studied by Quasi-Elastic Neutron-Scattering. Zeolites 1992, 12, 146-151.
-
(1992)
Zeolites
, vol.12
, pp. 146-151
-
-
Jobic, H.1
Bee, M.2
Kearley, G.J.3
-
36
-
-
0035310610
-
Quasi-Elastic Neutron Scattering Study of the Mobilit of Methane in Microporous Silica
-
Benes, N. E.; Jobic, H.; Vverweij, H. Quasi-Elastic Neutron Scattering Study of the Mobilit of Methane in Microporous Silica. Microporous Mesoporous Mater. 2001, 43, 147.
-
(2001)
Microporous Mesoporous Mater.
, vol.43
, pp. 147
-
-
Benes, N.E.1
Jobic, H.2
Vverweij, H.3
-
37
-
-
0035963789
-
PFG NMR Study of Diffusion in MFI-Type Zeolites: Evidence of the Existence of Intracrystalline Transport Barriers
-
Vasenov, S.; Bohlmann, W.; Galvosas, P.; Geier, O.; Liu, H.; Karger, J. PFG NMR Study of Diffusion in MFI-Type Zeolites: Evidence of the Existence of Intracrystalline Transport Barriers. J. Phys. Chem. B 2001, 105, 5922-5927.
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 5922-5927
-
-
Vasenov, S.1
Bohlmann, W.2
Galvosas, P.3
Geier, O.4
Liu, H.5
Karger, J.6
-
38
-
-
11744355003
-
Diffusion of a Mixture of Methane and Xenon in Silicalite: A Molecular Dynamics Study and Pulsed Field Gradient Nuclear Magnetic Resonance Experiments
-
Jost, S.; Bar, N. K.; Fritzsche, S.; Haberlandt, R.; Karger, J. Diffusion of a Mixture of Methane and Xenon in Silicalite: A Molecular Dynamics Study and Pulsed Field Gradient Nuclear Magnetic Resonance Experiments. J. Phys. Chem. B 1998, 102, 6375-6381.
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 6375-6381
-
-
Jost, S.1
Bar, N.K.2
Fritzsche, S.3
Haberlandt, R.4
Karger, J.5
-
39
-
-
37049093630
-
Self-Diffusion of N-Paraffins in NaX Zeolite
-
Karger, J.; Pfeifer, H.; Rauscher, M.; Walter, A. Self-Diffusion of N-Paraffins in NaX Zeolite. J. Chem. Soc., Faraday Trans. I 1980, 76, 717-737.
-
(1980)
J. Chem. Soc., Faraday Trans. I
, vol.76
, pp. 717-737
-
-
Karger, J.1
Pfeifer, H.2
Rauscher, M.3
Walter, A.4
-
40
-
-
29144445802
-
Adsorption and Diffusion Behavior of Ethane and Ethylene in Sol-Gel Derived Microporous Silica
-
Dewitt, A. C.; Herwig, K. W.; Lombardo, S. J. Adsorption and Diffusion Behavior of Ethane and Ethylene in Sol-Gel Derived Microporous Silica. Adsorption 2005, 11, 491-499.
-
(2005)
Adsorption
, vol.11
, pp. 491-499
-
-
Dewitt, A.C.1
Herwig, K.W.2
Lombardo, S.J.3
-
41
-
-
84863075990
-
Effect of the Methanol-to-Olefin Conversion on the PFG NMR Self-Diffusivities of Ethane and Ethene in Large-Crystalline SAPO-34
-
Dai, W.; Scheibe, M.; Li, L.; Guan, N.; Hunger, M. Effect of the Methanol-to-Olefin Conversion on the PFG NMR Self-Diffusivities of Ethane and Ethene in Large-Crystalline SAPO-34. J. Phys. Chem. C 2012, 116, 2469-2476.
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 2469-2476
-
-
Dai, W.1
Scheibe, M.2
Li, L.3
Guan, N.4
Hunger, M.5
-
42
-
-
37049092053
-
Microdynamics of Methane, Ethane and Propane in ZSM-5 Type Zeolites
-
Caro, J.; Bulow, M.; Schirmer, W.; Karger, J.; Heink, W.; Pfeifer, H.; Zdanov, S. P. Microdynamics of Methane, Ethane and Propane in ZSM-5 Type Zeolites. J. Chem. Soc., Faraday Trans. I 1985, 81, 2541-2550.
-
(1985)
J. Chem. Soc., Faraday Trans. I
, vol.81
, pp. 2541-2550
-
-
Caro, J.1
Bulow, M.2
Schirmer, W.3
Karger, J.4
Heink, W.5
Pfeifer, H.6
Zdanov, S.P.7
-
43
-
-
37349007705
-
PFG NMR Self-Diffusion of Small Hydrocarbons in High Silica DDR, CHA and LTA Structures
-
Hedin, N.; Demartin, G. J.; Roth, W. J.; Strohmaier, K. G. PFG NMR Self-Diffusion of Small Hydrocarbons in High Silica DDR, CHA and LTA Structures. Microporous Mesoporous Mater. 2008, 109, 327-334.
-
(2008)
Microporous Mesoporous Mater.
, vol.109
, pp. 327-334
-
-
Hedin, N.1
Demartin, G.J.2
Roth, W.J.3
Strohmaier, K.G.4
-
44
-
-
84856970819
-
Carbon Dioxide Capture in Metal-Organic Frameworks
-
Sumida, K.; Rogow, D. L.; Mason, J. a; McDonald, T. M.; Bloch, E. D.; Herm, Z. R.; Bae, T.-H.; Long, J. R. Carbon Dioxide Capture in Metal-Organic Frameworks. Chem. Rev. 2012, 112, 724-781.
-
(2012)
Chem. Rev.
, vol.112
, pp. 724-781
-
-
Sumida, K.1
Rogow, D.L.2
Mason, J.A.3
McDonald, T.M.4
Bloch, E.D.5
Herm, Z.R.6
Bae, T.-H.7
Long, J.R.8
-
45
-
-
84899716603
-
Methane Storage in Metal-Organic Frameworks
-
He, Y.; Zhou, W.; Qian, G.; Chen, B. Methane Storage in Metal-Organic Frameworks. Chem. Soc. Rev. 2014, 43, 5657-5678.
-
(2014)
Chem. Soc. Rev.
, vol.43
, pp. 5657-5678
-
-
He, Y.1
Zhou, W.2
Qian, G.3
Chen, B.4
-
46
-
-
84888602334
-
Evaluating Metal-organic Frameworks for Natural Gas Storage
-
Mason, J. a.; Veenstra, M.; Long, J. R. Evaluating Metal-organic Frameworks for Natural Gas Storage. Chem. Sci. 2014, 5, 32-51.
-
(2014)
Chem. Sci.
, vol.5
, pp. 32-51
-
-
Mason, J.A.1
Veenstra, M.2
Long, J.R.3
-
47
-
-
84863011092
-
Hydrogen Storage in Metal-Organic Frameworks
-
Suh, M. P.; Park, H. J.; Prasad, T. K.; Lim, D.-W. Hydrogen Storage in Metal-Organic Frameworks. Chem. Rev. 2012, 112, 782-835.
-
(2012)
Chem. Rev.
, vol.112
, pp. 782-835
-
-
Suh, M.P.1
Park, H.J.2
Prasad, T.K.3
Lim, D.-W.4
-
48
-
-
84867398118
-
Diffusion of Long Chain N-Alkanes in the Metal-organic Framework MIL-47(V): A Combination of Neutron Scattering Experiments and Molecular Dynamics Simulations
-
Rives, S.; Jobic, H.; Ragon, F.; Devic, T.; Serre, C.; Férey, G.; Ollivier, J.; Maurin, G. Diffusion of Long Chain N-Alkanes in the Metal-organic Framework MIL-47(V): A Combination of Neutron Scattering Experiments and Molecular Dynamics Simulations. Microporous Mesoporous Mater. 2012, 164, 259-265.
-
(2012)
Microporous Mesoporous Mater.
, vol.164
, pp. 259-265
-
-
Rives, S.1
Jobic, H.2
Ragon, F.3
Devic, T.4
Serre, C.5
Férey, G.6
Ollivier, J.7
Maurin, G.8
-
49
-
-
38149015564
-
Hybrid Porous Solids: Past, Present, Future
-
Férey, G. Hybrid Porous Solids: Past, Present, Future. Chem. Soc. Rev. 2008, 37, 191-214.
-
(2008)
Chem. Soc. Rev.
, vol.37
, pp. 191-214
-
-
Férey, G.1
-
50
-
-
84884879427
-
A Water Stable Metal-Organic Framework with Optimal Features for CO2 Capture
-
Yang, Q.; Vaesen, S.; Ragon, F.; Wiersum, A. D.; Wu, D.; Lago, A.; Devic, T.; Martineau, C.; Taulelle, F.; Llewellyn, P. L.; et al. A Water Stable Metal-Organic Framework with Optimal Features for CO2 Capture. Angew. Chem., Int. Ed. Engl. 2013, 52, 10316-10320.
-
(2013)
Angew. Chem., Int. Ed. Engl.
, vol.52
, pp. 10316-10320
-
-
Yang, Q.1
Vaesen, S.2
Ragon, F.3
Wiersum, A.D.4
Wu, D.5
Lago, A.6
Devic, T.7
Martineau, C.8
Taulelle, F.9
Llewellyn, P.L.10
-
51
-
-
65149105984
-
Industrial Applications of Metal-Organic Frameworks
-
Czaja, A. U.; Trukhan, N.; Muller, U. Industrial Applications of Metal-Organic Frameworks. Chem. Soc. Rev. 2009, 38, 1284-1293.
-
(2009)
Chem. Soc. Rev.
, vol.38
, pp. 1284-1293
-
-
Czaja, A.U.1
Trukhan, N.2
Muller, U.3
-
52
-
-
84904319047
-
Adsorptive Separation on Metal-organic Frameworks in the Liquid Phase
-
Voorde, B. Van De; Bueken, B.; Vos, D. De. Adsorptive Separation on Metal-organic Frameworks in the Liquid Phase. Chem. Soc. Rev. 2014, 43, 5766-5788.
-
(2014)
Chem. Soc. Rev.
, vol.43
, pp. 5766-5788
-
-
Voorde, B.V.D.1
Bueken, B.2
Vos, D.D.3
-
53
-
-
84904727906
-
Tuning the Structure and Function of Metal-Organic Frameworks via Linker Design
-
Lu, W.; Wei, Z.; Gu, Z.-Y.; Liu, T.-F.; Park, J.; Park, J.; Tian, J.; Zhang, M.; Zhang, Q.; Gentle Iii, T.; et al. Tuning the Structure and Function of Metal-Organic Frameworks via Linker Design. Chem. Soc. Rev. 2014, 43, 5561-5593.
-
(2014)
Chem. Soc. Rev.
, vol.43
, pp. 5561-5593
-
-
Lu, W.1
Wei, Z.2
Gu, Z.-Y.3
Liu, T.-F.4
Park, J.5
Park, J.6
Tian, J.7
Zhang, M.8
Zhang, Q.9
Gentle, T.10
-
54
-
-
55749107996
-
Adsorption and Diffusion of Alkanes in CuBTC Crystals Investigated Using Infra-Red Microscopy and Molecular Simulations
-
Chmelik, C.; Kärger, J.; Wiebcke, M.; Caro, J.; van Baten, J. M.; Krishna, R. Adsorption and Diffusion of Alkanes in CuBTC Crystals Investigated Using Infra-Red Microscopy and Molecular Simulations. Microporous Mesoporous Mater. 2009, 117, 22-32.
-
(2009)
Microporous Mesoporous Mater.
, vol.117
, pp. 22-32
-
-
Chmelik, C.1
Kärger, J.2
Wiebcke, M.3
Caro, J.4
Van Baten, J.M.5
Krishna, R.6
-
55
-
-
77649154358
-
Mass Transfer in a Nanoscale Material Enhanced by an Opposing Flux
-
Chmelik, C.; Bux, H.; Caro, J.; Heinke, L.; Hibbe, F.; Titze, T.; Karger, J. Mass Transfer in a Nanoscale Material Enhanced by an Opposing Flux. Phys. Rev. Lett. 2010, 104, 085902.
-
(2010)
Phys. Rev. Lett.
, vol.104
, pp. 085902
-
-
Chmelik, C.1
Bux, H.2
Caro, J.3
Heinke, L.4
Hibbe, F.5
Titze, T.6
Karger, J.7
-
56
-
-
77953505576
-
Self-Diffusion Studies in CuBTC by PFG NMR and MD Simulations
-
Wehring, M.; Gascon, J.; Dubbeldam, D.; Kapteijn, F.; Snurr, R. Q.; Stallmach, F. Self-Diffusion Studies in CuBTC by PFG NMR and MD Simulations. J. Phys. Chem. C 2010, 114, 10527-10534.
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 10527-10534
-
-
Wehring, M.1
Gascon, J.2
Dubbeldam, D.3
Kapteijn, F.4
Snurr, R.Q.5
Stallmach, F.6
-
57
-
-
33746298908
-
NMR Studies on the Diffusion of Hydrocarbons on the Metal-Organic Framework Material MOF-5
-
Stallmach, F.; Gröger, S.; Künzel, V.; Kärger, J.; Yaghi, O. M.; Hesse, M.; Müller, U. NMR Studies on the Diffusion of Hydrocarbons on the Metal-Organic Framework Material MOF-5. Angew. Chem., Int. Ed. Engl. 2006, 45, 2123-2126.
-
(2006)
Angew. Chem., Int. Ed. Engl.
, vol.45
, pp. 2123-2126
-
-
Stallmach, F.1
Gröger, S.2
Künzel, V.3
Kärger, J.4
Yaghi, O.M.5
Hesse, M.6
Müller, U.7
-
58
-
-
80052957462
-
Ethene/ethane Mixture Diffusion in the MOF Sieve ZIF-8 Studied by MAS PFG NMR Diffusometry
-
Chmelik, C.; Freude, D.; Bux, H.; Haase, J. Ethene/ethane Mixture Diffusion in the MOF Sieve ZIF-8 Studied by MAS PFG NMR Diffusometry. Microporous Mesoporous Mater. 2012, 147, 135-141.
-
(2012)
Microporous Mesoporous Mater.
, vol.147
, pp. 135-141
-
-
Chmelik, C.1
Freude, D.2
Bux, H.3
Haase, J.4
-
59
-
-
24944463854
-
Self-Diffusion and Transport Diffusion of Light Gases in Metal-Organic Framework Materials Assessed Using Molecular Dynamics Simulations
-
Skoulidas, A. I.; Scholl, D. S. Self-Diffusion and Transport Diffusion of Light Gases in Metal-Organic Framework Materials Assessed Using Molecular Dynamics Simulations. J. Phys. Chem. B 2005, 109, 15760-15768.
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 15760-15768
-
-
Skoulidas, A.I.1
Scholl, D.S.2
-
60
-
-
76049091380
-
Investigating the Reasons for the Significant Influence of Lattice Flexibility on Self-Diffusivity of Ethane in Zn(tbip)
-
Seehamart, K.; Nanok, T.; Kärger, J.; Chmelik, C.; Krishna, R.; Fritzsche, S. Investigating the Reasons for the Significant Influence of Lattice Flexibility on Self-Diffusivity of Ethane in Zn(tbip). Microporous Mesoporous Mater. 2010, 130, 92-96.
-
(2010)
Microporous Mesoporous Mater.
, vol.130
, pp. 92-96
-
-
Seehamart, K.1
Nanok, T.2
Kärger, J.3
Chmelik, C.4
Krishna, R.5
Fritzsche, S.6
-
61
-
-
67349242561
-
A Molecular Dynamics Investigation of the Influence of Framework Flexibility on Self-Diffusivity of Ethane in Zn(tbip) Frameworks
-
Seehamart, K.; Nanok, T.; Krishna, R.; Baten, J. M.; Van Remsungnen, T.; Fritzsche, S. A Molecular Dynamics Investigation of the Influence of Framework Flexibility on Self-Diffusivity of Ethane in Zn(tbip) Frameworks. Microporous Mesoporous Mater. 2009, 125, 97-100.
-
(2009)
Microporous Mesoporous Mater.
, vol.125
, pp. 97-100
-
-
Seehamart, K.1
Nanok, T.2
Krishna, R.3
Baten, J.M.4
Van Remsungnen, T.5
Fritzsche, S.6
-
62
-
-
79955927180
-
Microporous and Mesoporous Materials Molecular Dynamics Investigation of the Self-Diffusion of Binary Mixture Diffusion in the Metal-Organic Framework Zn (Tbip) Accounting for Framework Flexibility
-
Seehamart, K.; Chmelik, C.; Krishna, R.; Fritzsche, S. Microporous and Mesoporous Materials Molecular Dynamics Investigation of the Self-Diffusion of Binary Mixture Diffusion in the Metal-Organic Framework Zn (Tbip) Accounting for Framework Flexibility. Microporous Mesoporous Mater. 2011, 143, 125-131.
-
(2011)
Microporous Mesoporous Mater.
, vol.143
, pp. 125-131
-
-
Seehamart, K.1
Chmelik, C.2
Krishna, R.3
Fritzsche, S.4
-
63
-
-
67650080631
-
Molecular Insight into Adsorption and Diffusion of Alkane Isomer Mixtures in Metal-Organic Frameworks
-
Babarao, R.; Tong, Y. H.; Jiang, J. J. W. Molecular Insight into Adsorption and Diffusion of Alkane Isomer Mixtures in Metal-Organic Frameworks. J. Phys. Chem. B 2009, 113, 9129-9136.
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 9129-9136
-
-
Babarao, R.1
Tong, Y.H.2
Jiang, J.J.W.3
-
64
-
-
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
-
65
-
-
84878366072
-
Diffusion of Binary CO2/CH4Mixtures in the MIL-47(V) and MIL-53(Cr) Metal-Organic Framework Type Solids: A Combination of Neutron Scattering Measurements and Molecular Dynamics Simulations
-
Salles, F.; Jobic, H.; Devic, T.; Guillerm, V.; Serre, C.; Koza, M. M.; Ferey, G.; Maurin, G. Diffusion of Binary CO2/CH4Mixtures in the MIL-47(V) and MIL-53(Cr) Metal-Organic Framework Type Solids: A Combination of Neutron Scattering Measurements and Molecular Dynamics Simulations. J. Phys. Chem. C 2013, 117, 11275-11284.
-
(2013)
J. Phys. Chem. C
, vol.117
, pp. 11275-11284
-
-
Salles, F.1
Jobic, H.2
Devic, T.3
Guillerm, V.4
Serre, C.5
Koza, M.M.6
Ferey, G.7
Maurin, G.8
-
66
-
-
79960383880
-
Exploration of the Long-Chain N-Alkanes Adsorption and Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools
-
Deroche, I.; Rives, S.; Trung Khuong, T.; Yang, Q.; Ghoufi, A.; Ramsahye, N. A.; Trens, P.; Fajula, F.; Devic, T.; Serre, C.; et al. Exploration of the Long-Chain N-Alkanes Adsorption and Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools. J. Phys. Chem. C 2011, 115, 13868-13876.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13868-13876
-
-
Deroche, I.1
Rives, S.2
Trung Khuong, T.3
Yang, Q.4
Ghoufi, A.5
Ramsahye, N.A.6
Trens, P.7
Fajula, F.8
Devic, T.9
Serre, C.10
-
67
-
-
84903754599
-
Diffusion of Light Hydrocarbons in the Flexible MIL-53(Cr) Metal-Organic Framework: A Combination of Quasi-Elastic Neutron Scattering Experiments and Molecular Dynamics Simulations
-
Rosenbach, N., Jnr; Jobic, H.; Ghoufi, A.; Devic, T.; Koza, M. M.; Ramsahye, N. A.; Mota, C. J.; Serre, C.; Maurin, G. Diffusion of Light Hydrocarbons in the Flexible MIL-53(Cr) Metal-Organic Framework: A Combination of Quasi-Elastic Neutron Scattering Experiments and Molecular Dynamics Simulations. J. Phys. Chem. C 2014, 118, 14471-14477.
-
(2014)
J. Phys. Chem. C
, vol.118
, pp. 14471-14477
-
-
Rosenbach, N.1
Jobic, H.2
Ghoufi, A.3
Devic, T.4
Koza, M.M.5
Ramsahye, N.A.6
Mota, C.J.7
Serre, C.8
Maurin, G.9
-
68
-
-
70350020781
-
Transport Diffusivity of CO2 in the Highly Flexible Metal-Organic Framework MIL-53(Cr)
-
Salles, F.; Jobic, H.; Ghoufi, A.; Llewellyn, P. L.; Serre, C.; Bourrelly, S.; Férey, G.; Maurin, G. Transport Diffusivity of CO2 in the Highly Flexible Metal-Organic Framework MIL-53(Cr). Angew. Chem., Int. Ed. Engl. 2009, 48, 8335-8339.
-
(2009)
Angew. Chem., Int. Ed. Engl.
, vol.48
, pp. 8335-8339
-
-
Salles, F.1
Jobic, H.2
Ghoufi, A.3
Llewellyn, P.L.4
Serre, C.5
Bourrelly, S.6
Férey, G.7
Maurin, G.8
-
69
-
-
84879832304
-
Diffusion of Branched and Linear C 6 -Alkanes in the
-
Rives, S.; Jobic, H.; Ollivier, J.; Yang, K. Diffusion of Branched and Linear C 6 -Alkanes in the. J. Phys. Soc. Jpn. 2013, 82, SA005-1-SA005-13.
-
(2013)
J. Phys. Soc. Jpn.
, vol.82
, pp. SA0051-SA00513
-
-
Rives, S.1
Jobic, H.2
Ollivier, J.3
Yang, K.4
-
70
-
-
79960383880
-
Exploration of the Long-Chain N-Alkanes Adsorption and Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools
-
Rives, S.; Trung, T.; Yang, Q.; Ghou, A.; Ramsahye, N. A.; Trens, P.; Fajula, F.; Devic, T.; Serre, C.; Jobic, H.; et al. Exploration of the Long-Chain N-Alkanes Adsorption and Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools. J. Phys. Chem. C 2011, 115, 13868-13876.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13868-13876
-
-
Rives, S.1
Trung, T.2
Yang, Q.3
Ghou, A.4
Ramsahye, N.A.5
Trens, P.6
Fajula, F.7
Devic, T.8
Serre, C.9
Jobic, H.10
-
71
-
-
77956424520
-
Unusual Chain-Length Dependence of the Diffusion of N-Alkanes in the Metal-Organic Framework MIL-47(V): The Blowgun Effect
-
Jobic, H.; Rosenbach, N.; Ghoufi, A.; Kolokolov, D. I.; Yot, P. G.; Devic, T.; Serre, C.; Férey, G.; Maurin, G. Unusual Chain-Length Dependence of the Diffusion of N-Alkanes in the Metal-Organic Framework MIL-47(V): The Blowgun Effect. Chem. - Eur. J. 2010, 16, 10337-10341.
-
(2010)
Chem. - Eur. J.
, vol.16
, pp. 10337-10341
-
-
Jobic, H.1
Rosenbach, N.2
Ghoufi, A.3
Kolokolov, D.I.4
Yot, P.G.5
Devic, T.6
Serre, C.7
Férey, G.8
Maurin, G.9
-
72
-
-
84872818581
-
Probing the Hydrogen Equilibrium and Kinetics in Zeolite Imidazolate Frameworks via Molecular Dynamics and Quasi-Elastic Neutron Scattering Experiments
-
Pantatosaki, E.; Jobic, H.; Kolokolov, D. I.; Karmakar, S.; Bibiwale, R.; Papadopoulos, G. K. Probing the Hydrogen Equilibrium and Kinetics in Zeolite Imidazolate Frameworks via Molecular Dynamics and Quasi-Elastic Neutron Scattering Experiments. J. Chem. Phys. 2013, 138, 034706.
-
(2013)
J. Chem. Phys.
, vol.138
, pp. 034706
-
-
Pantatosaki, E.1
Jobic, H.2
Kolokolov, D.I.3
Karmakar, S.4
Bibiwale, R.5
Papadopoulos, G.K.6
-
73
-
-
79960406248
-
Understanding the Thermodynamic and Kinetic Behavior of the CO2/CH4 Gas Mixture within the Porous Zirconium Terephthalate UiO-66(Zr): A Joint Experimental and Modeling Approach
-
Yang, Q.; Wiersum, A. D.; Jobic, H.; Guillerm, V.; Serre, C.; Llewellyn, P. L. P. L.; Maurin, G. Understanding the Thermodynamic and Kinetic Behavior of the CO2/CH4 Gas Mixture within the Porous Zirconium Terephthalate UiO-66(Zr): A Joint Experimental and Modeling Approach. J. Phys. Chem. C 2011, 115, 13768-13774.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13768-13774
-
-
Yang, Q.1
Wiersum, A.D.2
Jobic, H.3
Guillerm, V.4
Serre, C.5
Llewellyn, P.L.P.L.6
Maurin, G.7
-
74
-
-
79960417076
-
Probing the Dynamics of CO2 and CH4 within the Porous Zirconium Terephthalate UiO-66(Zr): A Synergic Combination of Neutron Scattering Measurements and Molecular Simulations
-
Yang, Q.; Jobic, H.; Salles, F.; Kolokolov, D.; Guillerm, V.; Serre, C.; Maurin, G. Probing the Dynamics of CO2 and CH4 within the Porous Zirconium Terephthalate UiO-66(Zr): A Synergic Combination of Neutron Scattering Measurements and Molecular Simulations. Chem. - Eur. J. 2011, 17, 8882-8889.
-
(2011)
Chem. - Eur. J.
, vol.17
, pp. 8882-8889
-
-
Yang, Q.1
Jobic, H.2
Salles, F.3
Kolokolov, D.4
Guillerm, V.5
Serre, C.6
Maurin, G.7
-
75
-
-
54249103593
-
A New Zirconium Inorganic Building Brick Forming Metal Organic Frameworks with Exceptional Stability
-
Cavka, J. H.; Jakobsen, S.; Olsbye, U.; Guillou, N.; Lamberti, C.; Bordiga, S.; Lillerud, K. P. A New Zirconium Inorganic Building Brick Forming Metal Organic Frameworks with Exceptional Stability. J. Am. Chem. Soc. 2008, 130, 13850-13851.
-
(2008)
J. Am. Chem. Soc.
, vol.130
, pp. 13850-13851
-
-
Cavka, J.H.1
Jakobsen, S.2
Olsbye, U.3
Guillou, N.4
Lamberti, C.5
Bordiga, S.6
Lillerud, K.P.7
-
76
-
-
84865846464
-
A Series of Isoreticular, Highly Stable, Porous Zirconium Oxide Based Metal-Organic Frameworks
-
Guillerm, V.; Ragon, F.; Dan-Hardi, M.; Devic, T.; Vishnuvarthan, M.; Campo, B.; Vimont, A.; Clet, G.; Yang, Q.; Maurin, G.; et al. A Series of Isoreticular, Highly Stable, Porous Zirconium Oxide Based Metal-Organic Frameworks. Angew. Chem., Int. Ed. Engl. 2012, 51, 9267.
-
(2012)
Angew. Chem., Int. Ed. Engl.
, vol.51
, pp. 9267
-
-
Guillerm, V.1
Ragon, F.2
Dan-Hardi, M.3
Devic, T.4
Vishnuvarthan, M.5
Campo, B.6
Vimont, A.7
Clet, G.8
Yang, Q.9
Maurin, G.10
-
77
-
-
82455186491
-
An Evaluation of UiO-66 for Gas-Based Applications
-
Wiersum, A. D.; Soubeyrand-Lenoir, E.; Yang, Q.; Moulin, B.; Guillerm, V.; Ben Yahia, M.; Bourrelly, S.; Vimont, A.; Miller, S.; Vagner, C.; et al. An Evaluation of UiO-66 for Gas-Based Applications. Chem. Asian J. 2011, 6, 3270.
-
(2011)
Chem. Asian J.
, vol.6
, pp. 3270
-
-
Wiersum, A.D.1
Soubeyrand-Lenoir, E.2
Yang, Q.3
Moulin, B.4
Guillerm, V.5
Ben Yahia, M.6
Bourrelly, S.7
Vimont, A.8
Miller, S.9
Vagner, C.10
-
78
-
-
80051766845
-
Functionalizing Porous Zirconium Terephthalate UiO- 66(Zr) for Natural Gas Upgrading: A Computational Exploration
-
Yang, Q.; Wiersum, A. D.; Llewellyn, P. L.; Guillerm, V.; Serre, C.; Maurin, G. Functionalizing Porous Zirconium Terephthalate UiO- 66(Zr) for Natural Gas Upgrading: A Computational Exploration. Chem. Commun. 2011, 47, 9603.
-
(2011)
Chem. Commun.
, vol.47
, pp. 9603
-
-
Yang, Q.1
Wiersum, A.D.2
Llewellyn, P.L.3
Guillerm, V.4
Serre, C.5
Maurin, G.6
-
79
-
-
84868713198
-
Rational Tuning of Water Vapor and CO2 Adsorption in Highly Stable Zr-Based MOFs
-
Jasuja, H.; Zang, J.; Sholl, D. S.; Walton, K. S. Rational Tuning of Water Vapor and CO2 Adsorption in Highly Stable Zr-Based MOFs. J. Phys. Chem. C 2012, 116, 23526-23532.
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 23526-23532
-
-
Jasuja, H.1
Zang, J.2
Sholl, D.S.3
Walton, K.S.4
-
80
-
-
84876233927
-
A General Strategy for the Synthesis of Functionalised UiO-66 Frameworks: Characterisation, Stability and CO2 Adsorption Properties
-
Biswas, S.; van der Voort, P. A General Strategy for the Synthesis of Functionalised UiO-66 Frameworks: Characterisation, Stability and CO2 Adsorption Properties. Eur. J. Inorg. Chem. 2013, 2154-2160.
-
(2013)
Eur. J. Inorg. Chem.
, pp. 2154-2160
-
-
Biswas, S.1
Van Der Voort, P.2
-
81
-
-
84896830656
-
Adsorption of Xylene Isomers in MOF UiO-66 by Molecular Simulation
-
Granato, M. A.; Martins, V. D.; Ferreira, A. F. P.; Rodrigues, A. E. Adsorption of Xylene Isomers in MOF UiO-66 by Molecular Simulation. Microporous Mesoporous Mater. 2014, 190, 165-170.
-
(2014)
Microporous Mesoporous Mater.
, vol.190
, pp. 165-170
-
-
Granato, M.A.1
Martins, V.D.2
Ferreira, A.F.P.3
Rodrigues, A.E.4
-
82
-
-
84902194346
-
Microwave-Assisted Modulated Synthesis of Zirconium-Based Metal-Organic Framework (Zr-MOF) for Hydrogen Storage Applications
-
Ren, J. W.; Segakweng, T.; Langmi, H. W.; Musyoka, N. M.; North, B. C.; Mathe, M.; Bessarabov, D. Microwave-Assisted Modulated Synthesis of Zirconium-Based Metal-Organic Framework (Zr-MOF) for Hydrogen Storage Applications. Int. J. Mater. Res. 2014, 105, 516-519.
-
(2014)
Int. J. Mater. Res.
, vol.105
, pp. 516-519
-
-
Ren, J.W.1
Segakweng, T.2
Langmi, H.W.3
Musyoka, N.M.4
North, B.C.5
Mathe, M.6
Bessarabov, D.7
-
83
-
-
84893616170
-
High Gas Storage Capacities and Stepwise Adsorption in a UiO Type Metal-Organic Framework Incorporating Lewis Basic Bipyridyl Sites
-
Li, L. J.; Tang, S. F.; Wang, C.; Lv, X. X.; Jiang, M.; Wu, H. Z.; Zhao, X. B. High Gas Storage Capacities and Stepwise Adsorption in a UiO Type Metal-Organic Framework Incorporating Lewis Basic Bipyridyl Sites. Chem. Commun. 2014, 50, 2304-2307.
-
(2014)
Chem. Commun.
, vol.50
, pp. 2304-2307
-
-
Li, L.J.1
Tang, S.F.2
Wang, C.3
Lv, X.X.4
Jiang, M.5
Wu, H.Z.6
Zhao, X.B.7
-
84
-
-
84896532192
-
Water Adsorption in Porous Metal- Organic Frameworks and Related Materials
-
Furukawa, H.; Gandara, F.; Zhang, Y. B.; Jiang, J. C.; Queen, W. L.; Hudson, M. R.; Yaghi, O. M. Water Adsorption in Porous Metal- Organic Frameworks and Related Materials. J. Am. Chem. Soc. 2014, 136, 4369-4381.
-
(2014)
J. Am. Chem. Soc.
, vol.136
, pp. 4369-4381
-
-
Furukawa, H.1
Gandara, F.2
Zhang, Y.B.3
Jiang, J.C.4
Queen, W.L.5
Hudson, M.R.6
Yaghi, O.M.7
-
85
-
-
84896737001
-
Unusual Chain Length Dependent Adsorption of Linear and Branched Alkanes on UiO-66
-
Duerinck, T.; Denayer, J. F. M. Unusual Chain Length Dependent Adsorption of Linear and Branched Alkanes on UiO-66. Adsorpt. Int. Adsorpt. Soc. 2014, 20, 251-259.
-
(2014)
Adsorpt. Int. Adsorpt. Soc.
, vol.20
, pp. 251-259
-
-
Duerinck, T.1
Denayer, J.F.M.2
-
86
-
-
84885092105
-
Adsorption and Separation of N-Hexane and Cyclohexane on the UiO-66 Metal-Organic Framework
-
Bozbiyik, B.; Duerinck, T.; Lannoeye, J.; De Vos, D. E.; Baron, G. V.; Denayer, J. F. M. Adsorption and Separation of N-Hexane and Cyclohexane on the UiO-66 Metal-Organic Framework. Microporous Mesoporous Mater. 2014, 183, 143-149.
-
(2014)
Microporous Mesoporous Mater.
, vol.183
, pp. 143-149
-
-
Bozbiyik, B.1
Duerinck, T.2
Lannoeye, J.3
De Vos, D.E.4
Baron, G.V.5
Denayer, J.F.M.6
-
87
-
-
84879431078
-
Understanding Hydrocarbon Adsorption in the UiO-66 Metal-Organic Framework: Separation of (Un)saturated Linear, Branched, Cyclic Adsorbates, Including Stereoisomers
-
Duerinck, T.; Bueno-Perez, R.; Vermoortele, F.; De Vos, D. E.; Calero, S.; Baron, G. V.; Denayer, J. F. M. Understanding Hydrocarbon Adsorption in the UiO-66 Metal-Organic Framework: Separation of (Un)saturated Linear, Branched, Cyclic Adsorbates, Including Stereoisomers. J. Phys. Chem. C 2013, 117, 12567-12578.
-
(2013)
J. Phys. Chem. C
, vol.117
, pp. 12567-12578
-
-
Duerinck, T.1
Bueno-Perez, R.2
Vermoortele, F.3
De Vos, D.E.4
Calero, S.5
Baron, G.V.6
Denayer, J.F.M.7
-
88
-
-
84880341127
-
Unusual and Highly Tunable Missing-Linker Defects in Zirconium Metal-Organic Framework UiO-66 and Their Important Effects on Gas Adsorption
-
Wu, H.; Chua, Y. S.; Krungleviciute, V.; Tyagi, M.; Chen, P.; Yildirim, T.; Zhou, W. Unusual and Highly Tunable Missing-Linker Defects in Zirconium Metal-Organic Framework UiO-66 and Their Important Effects on Gas Adsorption. J. Am. Chem. Soc. 2013, 135, 10525-10532.
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 10525-10532
-
-
Wu, H.1
Chua, Y.S.2
Krungleviciute, V.3
Tyagi, M.4
Chen, P.5
Yildirim, T.6
Zhou, W.7
-
89
-
-
84875978499
-
A Route to Drastic Increase of CO2 Uptake in Zr Metal Organic Framework UiO-66
-
Lau, C. H.; Babarao, R.; Hill, M. R. A Route to Drastic Increase of CO2 Uptake in Zr Metal Organic Framework UiO-66. Chem. Commun. 2013, 49, 3634-3636.
-
(2013)
Chem. Commun.
, vol.49
, pp. 3634-3636
-
-
Lau, C.H.1
Babarao, R.2
Hill, M.R.3
-
90
-
-
84884125851
-
The Effect of Water Adsorption on the Structure of the Carboxylate Containing Metal-Organic Frameworks Cu-BTC, Mg-MOF-74, and UiO-66
-
DeCoste, J. B.; Peterson, G. W.; Schindler, B. J.; Killops, K. L.; Browe, M. A.; Mahle, J. J. The Effect of Water Adsorption on the Structure of the Carboxylate Containing Metal-Organic Frameworks Cu-BTC, Mg-MOF-74, and UiO-66. J. Mater. Chem. A 2013, 1, 11922-11932.
-
(2013)
J. Mater. Chem. A
, vol.1
, pp. 11922-11932
-
-
DeCoste, J.B.1
Peterson, G.W.2
Schindler, B.J.3
Killops, K.L.4
Browe, M.A.5
Mahle, J.J.6
-
91
-
-
84868557344
-
Tuning the Adsorption Properties of UiO-66 via Ligand Functionalization
-
Cmarik, G. E.; Kim, M.; Cohen, S. M.; Walton, K. S. Tuning the Adsorption Properties of UiO-66 via Ligand Functionalization. Langmuir 2012, 28, 15606-15613.
-
(2012)
Langmuir
, vol.28
, pp. 15606-15613
-
-
Cmarik, G.E.1
Kim, M.2
Cohen, S.M.3
Walton, K.S.4
-
92
-
-
78649823527
-
Reverse Shape Selectivity in the Adsorption of Hexane and Xylene Isomers in MOF UiO-66
-
Barcia, P. S.; Guimaraes, D.; Mendes, P. A. P.; Silva, J. A. C.; Guillerm, V.; Chevreau, H.; Serre, C.; Rodrigues, A. E. Reverse Shape Selectivity in the Adsorption of Hexane and Xylene Isomers in MOF UiO-66. Microporous Mesoporous Mater. 2011, 139, 67-73.
-
(2011)
Microporous Mesoporous Mater.
, vol.139
, pp. 67-73
-
-
Barcia, P.S.1
Guimaraes, D.2
Mendes, P.A.P.3
Silva, J.A.C.4
Guillerm, V.5
Chevreau, H.6
Serre, C.7
Rodrigues, A.E.8
-
93
-
-
84896116481
-
The Effect of Pore Shape on Hydrocarbon Selectivity on UiO-66 (Zr), HKUST-1 and MIL-125 (Ti) Metal Organic Frameworks: Insights from Molecular Simulations and Chromatography
-
Ramsahye, N. A.; Trens, P.; Shepherd, C.; Gonzalez, P.; Khuong, T.; Ragon, F.; Serre, C. The Effect of Pore Shape on Hydrocarbon Selectivity on UiO-66 (Zr), HKUST-1 and MIL-125 (Ti) Metal Organic Frameworks: Insights from Molecular Simulations and Chromatography. Microporous Mesoporous Mater. 2014, 189, 222-231.
-
(2014)
Microporous Mesoporous Mater.
, vol.189
, pp. 222-231
-
-
Ramsahye, N.A.1
Trens, P.2
Shepherd, C.3
Gonzalez, P.4
Khuong, T.5
Ragon, F.6
Serre, C.7
-
94
-
-
79960406248
-
Understanding the Thermodynamic and Kinetic Behavior of the CO 2/CH 4 Gas Mixture within the Porous Zirconium Terephthalate UiO-66 (Zr): A Joint Experimental and Modeling Approach
-
Yang, Q.; Wiersum, A. D.; Guillerm, V.; Serre, C.; Llewellyn, P. L.; Maurin, G. Understanding the Thermodynamic and Kinetic Behavior of the CO 2/CH 4 Gas Mixture within the Porous Zirconium Terephthalate UiO-66 (Zr): A Joint Experimental and Modeling Approach. J. Phys. Chem. C 2011, 115, 13768-13774.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13768-13774
-
-
Yang, Q.1
Wiersum, A.D.2
Guillerm, V.3
Serre, C.4
Llewellyn, P.L.5
Maurin, G.6
-
95
-
-
84892491637
-
Computational Exploration of a Zr-Carboxylate Based Metal-Organic Framework as a Membrane Material for CO2 Capture
-
Wu, D.; Maurin, G.; Yang, Q.; Serre, C.; Jobic, H.; Zhong, C. Computational Exploration of a Zr-Carboxylate Based Metal-Organic Framework as a Membrane Material for CO2 Capture. J. Mater. Chem. A 2014, 2, 1657-1661.
-
(2014)
J. Mater. Chem. A
, vol.2
, pp. 1657-1661
-
-
Wu, D.1
Maurin, G.2
Yang, Q.3
Serre, C.4
Jobic, H.5
Zhong, C.6
-
96
-
-
17544373495
-
Gas Adsorption Microcalorimetry and Modelling to Characterise Zeolites and Related Materials
-
Llewellyn, P. L.; Maurin, G. Gas Adsorption Microcalorimetry and Modelling to Characterise Zeolites and Related Materials. C. R. Chim. 2005, 283-302.
-
(2005)
C. R. Chim.
, pp. 283-302
-
-
Llewellyn, P.L.1
Maurin, G.2
-
97
-
-
84949133909
-
Adsorption and Microcalorimetry on Molecular Sieves
-
van Bekkum, H., Cejka, J., Corma, A., Schuth, F., Eds.; Elsevier: New York
-
Llewellyn, P. L.; Maurin, G. Adsorption and Microcalorimetry on Molecular Sieves. In Introduction to Zeolite Molecular Seives; van Bekkum, H., Cejka, J., Corma, A., Schuth, F., Eds.; Elsevier: New York, 2007; pp 555-610.
-
(2007)
Introduction to Zeolite Molecular Seives
, pp. 555-610
-
-
Llewellyn, P.L.1
Maurin, G.2
-
98
-
-
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
-
99
-
-
77953345846
-
Adsorption of Light Hydrocarbons in the Flexible MIL-53(Cr) and Rigid MIL-47(V) Metal -organic Frameworks: A Combination of Molecular Simulationsand Microcalorimetry/gravimetry Measurements
-
Rosenbach, N., Jr.; Ghoufi, A.; Deroche, I.; Llewellyn, P. L.; Devic, T.; Bourrelly, S.; Serre, C.; Ferey, G.; Maurin, G. Adsorption of Light Hydrocarbons in the Flexible MIL-53(Cr) and Rigid MIL-47(V) Metal -organic Frameworks: A Combination of Molecular Simulationsand Microcalorimetry/gravimetry Measurements. Phys. Chem. Chem. Phys. 2010, 12, 6428-6437.
-
(2010)
Phys. Chem. Chem. Phys.
, vol.12
, pp. 6428-6437
-
-
Rosenbach, N.1
Ghoufi, A.2
Deroche, I.3
Llewellyn, P.L.4
Devic, T.5
Bourrelly, S.6
Serre, C.7
Ferey, G.8
Maurin, G.9
-
100
-
-
55149106542
-
Computing the Heat of Adsorption Using Molecular Simulations: The Effect of Strong Coulombic Interactions
-
Vlugt, T. J. H.; García-Pérez, E.; Dubbeldam, D.; Ban, S.; Calero, S. Computing the Heat of Adsorption Using Molecular Simulations: The Effect of Strong Coulombic Interactions. J. Chem. Theory Comput. 2008, 4, 1107.
-
(2008)
J. Chem. Theory Comput.
, vol.4
, pp. 1107
-
-
Vlugt, T.J.H.1
García-Pérez, E.2
Dubbeldam, D.3
Ban, S.4
Calero, S.5
-
101
-
-
0030175155
-
DL - POLY - 2. 0: A General-Purpose Parallel Molecular Dynamics Simulation Package Overall Design
-
Smith, W.; Forester, T. R. DL - POLY - 2. 0: A General-Purpose Parallel Molecular Dynamics Simulation Package Overall Design. J. Mol. Graph. 1996, 7855, 136-141.
-
(1996)
J. Mol. Graph.
, vol.7855
, pp. 136-141
-
-
Smith, W.1
Forester, T.R.2
-
103
-
-
0037118245
-
Transport Diffusivities of CH 4, CF 4, He, Ne, Ar, Xe, and SF 6 in Silicalite from Atomistic Simulations
-
Skoulidas, A. I.; Sholl, D. S. Transport Diffusivities of CH 4, CF 4, He, Ne, Ar, Xe, and SF 6 in Silicalite from Atomistic Simulations. J. Phys. Chem. B 2002, 106, 5058-5067.
-
(2002)
J. Phys. Chem. B
, vol.106
, pp. 5058-5067
-
-
Skoulidas, A.I.1
Sholl, D.S.2
-
104
-
-
0001061046
-
Transferable Potentials for Phase Equilibria. 1. United-Atom Description of N -Alkanes
-
Martin, M. G.; Siepmann, J. I. Transferable Potentials for Phase Equilibria. 1. United-Atom Description of N -Alkanes. J. Phys. Chem. B 1998, 102, 2569-2577.
-
(1998)
J. Phys. Chem. B
, vol.102
, pp. 2569-2577
-
-
Martin, M.G.1
Siepmann, J.I.2
-
105
-
-
9144240095
-
DREIDING: A Generic Force Field for Molecular Simulations
-
Mayo, S. L.; Olafson, B. D.; Goddard, W. A., III DREIDING: A Generic Force Field for Molecular Simulations. J. Phys. Chem. 1990, 94, 8897-8909.
-
(1990)
J. Phys. Chem.
, vol.94
, pp. 8897-8909
-
-
Mayo, S.L.1
Olafson, B.D.2
Goddard, W.A.3
-
106
-
-
0042041206
-
UFF, a Full Periodic Table Force Field for Molecular Mechanics and Molecular Dynamics Simulations
-
Rappé, A. K.; Casewit, C. J.; Colwell, K. S.; Goddard, W. A., III; 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
-
-
Rappé, A.K.1
Casewit, C.J.2
Colwell, K.S.3
Goddard, W.A.4
Skiff, W.M.5
-
107
-
-
84944484425
-
Ueber Die Anwendung des Satzes Vom Virial in der Kinetischen Theorie der Gases
-
Lorentz, H. A. Ueber Die Anwendung Des Satzes Vom Virial in Der Kinetischen Theorie Der Gases. Ann. Phys. 1881, 248, 127-136.
-
(1881)
Ann. Phys.
, vol.248
, pp. 127-136
-
-
Lorentz, H.A.1
-
109
-
-
78651361903
-
Hydrocarbon Adsorption in the Isostructural Metal Organic Frameworks MIL-53(Cr) and MIL-47(V)
-
Trung, T. K.; Déroche, I.; Rivera, A.; Yang, Q.; Yot, P.; Ramsahye, N.; Vinot, S. D.; Devic, T.; Horcajada, P.; Serre, C.; et al. Hydrocarbon Adsorption in the Isostructural Metal Organic Frameworks MIL-53(Cr) and MIL-47(V). Microporous Mesoporous Mater. 2011, 140, 114-119.
-
(2011)
Microporous Mesoporous Mater.
, vol.140
, pp. 114-119
-
-
Trung, T.K.1
Déroche, I.2
Rivera, A.3
Yang, Q.4
Yot, P.5
Ramsahye, N.6
Vinot, S.D.7
Devic, T.8
Horcajada, P.9
Serre, C.10
-
110
-
-
79960383880
-
Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools
-
Deroche, I.; Rives, S.; Trung Khuong, T.; Yang, Q.; Ghoufi, A.; Ramsahye, N. A.; Trens, P.; Fajula, F.; Devic, T.; Serre, C.; et al. Diffusion in the MOF-Type MIL-47 (V) Material by Combining Experimental and Molecular Simulation Tools. J. Phys. Chem. C 2011, 115, 13868-13876.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13868-13876
-
-
Deroche, I.1
Rives, S.2
Trung Khuong, T.3
Yang, Q.4
Ghoufi, A.5
Ramsahye, N.A.6
Trens, P.7
Fajula, F.8
Devic, T.9
Serre, C.10
-
111
-
-
34648819697
-
Loading Dependence of Self- Diffusivities of Gases in Zeolites
-
Krishna, R.; van Baten, J. M. Loading Dependence of Self- Diffusivities of Gases in Zeolites. Chem. Eng. Technol. 2007, 30, 1235-1241.
-
(2007)
Chem. Eng. Technol.
, vol.30
, pp. 1235-1241
-
-
Krishna, R.1
Van Baten, J.M.2
-
112
-
-
33750061400
-
High-Temperature Pulsed Field Gradient Nuclear Magnetic Resonance Self-Diffusion Measurements of N-Alkanes in MFI-Type Zeolites
-
Heink, W.; Karger, J.; Pfeifer, H.; Datema, K. P.; Nowak, A. K. High-Temperature Pulsed Field Gradient Nuclear Magnetic Resonance Self-Diffusion Measurements of N-Alkanes in MFI-Type Zeolites. J. Chem. Soc., Faraday. Trans. 1992, 88, 3505-3509.
-
(1992)
J. Chem. Soc., Faraday. Trans.
, vol.88
, pp. 3505-3509
-
-
Heink, W.1
Karger, J.2
Pfeifer, H.3
Datema, K.P.4
Nowak, A.K.5
-
113
-
-
84856545914
-
The Effect of Framework Flexibility on Diffusion of Small Molecules in the Metal- Organic Framework IRMOF-1
-
Ford, D. C.; Dubbeldam, D.; Snurr, R. Q. The Effect of Framework Flexibility on Diffusion of Small Molecules in the Metal- Organic Framework IRMOF-1. Diffus. Fundam. 2009, 11, 1-8.
-
(2009)
Diffus. Fundam.
, vol.11
, pp. 1-8
-
-
Ford, D.C.1
Dubbeldam, D.2
Snurr, R.Q.3
-
114
-
-
33644917435
-
Dynamically Corrected Transition State Theory Calculations of Self-Diffusion in Anisotropic Nanoporous Materials
-
Dubbeldam, D.; Beerdsen, E.; Calero, S.; Smit, B. Dynamically Corrected Transition State Theory Calculations of Self-Diffusion in Anisotropic Nanoporous Materials. J. Phys. Chem. B 2006, 110, 3164-3172.
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 3164-3172
-
-
Dubbeldam, D.1
Beerdsen, E.2
Calero, S.3
Smit, B.4
-
115
-
-
79960413986
-
Influence of Zeolite Surface in the Sorption of Methane from Molecular Dynamics
-
Combariza, A. F.; Sastre, G. Influence of Zeolite Surface in the Sorption of Methane from Molecular Dynamics. J. Phys. Chem. C 2011, 115, 13751-13758.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 13751-13758
-
-
Combariza, A.F.1
Sastre, G.2
|