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Showing items 31-55 of 58 (3 Page(s) Totally)
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Institution	Date	Title	Author
臺大學術典藏	2022-05-24T06:10:50Z	Force-field development from electronic structure calculations with periodic boundary conditions: Applications to gaseous adsorption and transport in metal-organic frameworks	Lin L.-C.;Lee K.;Gagliardi L.;Neaton J.B.;Smit B.; Lin L.-C.; Lee K.; Gagliardi L.; Neaton J.B.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:50Z	Force-field development from electronic structure calculations with periodic boundary conditions: Applications to gaseous adsorption and transport in metal-organic frameworks	Lin L.-C.;Lee K.;Gagliardi L.;Neaton J.B.;Smit B.; Lin L.-C.; Lee K.; Gagliardi L.; Neaton J.B.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:50Z	Optimizing nanoporous materials for gas storage	Simon C.M.;Kim J.;Lin L.-C.;Martin R.L.;Haranczyk M.;Smit B.; Simon C.M.; Kim J.; Lin L.-C.; Martin R.L.; Haranczyk M.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:50Z	Optimizing nanoporous materials for gas storage	Simon C.M.;Kim J.;Lin L.-C.;Martin R.L.;Haranczyk M.;Smit B.; Simon C.M.; Kim J.; Lin L.-C.; Martin R.L.; Haranczyk M.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:50Z	Efficient determination of accurate force fields for porous materials using ab initio total energy calculations	Kim J.;Lin L.-C.;Lee K.;Neaton J.B.;Smit B.; Kim J.; Lin L.-C.; Lee K.; Neaton J.B.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:50Z	Efficient determination of accurate force fields for porous materials using ab initio total energy calculations	Kim J.;Lin L.-C.;Lee K.;Neaton J.B.;Smit B.; Kim J.; Lin L.-C.; Lee K.; Neaton J.B.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	CO2 adsorption in Fe2(dobdc): A classical force field parameterized from quantum mechanical calculations	Borycz J.;Lin L.-C.;Bloch E.D.;Kim J.;Dzubak A.L.;Maurice R.;Semrouni D.;Lee K.;Smit B.;Gagliardi L.; Borycz J.; Lin L.-C.; Bloch E.D.; Kim J.; Dzubak A.L.; Maurice R.; Semrouni D.; Lee K.; Smit B.; Gagliardi L.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	CO2 adsorption in Fe2(dobdc): A classical force field parameterized from quantum mechanical calculations	Borycz J.;Lin L.-C.;Bloch E.D.;Kim J.;Dzubak A.L.;Maurice R.;Semrouni D.;Lee K.;Smit B.;Gagliardi L.; Borycz J.; Lin L.-C.; Bloch E.D.; Kim J.; Dzubak A.L.; Maurice R.; Semrouni D.; Lee K.; Smit B.; Gagliardi L.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	Evaluating different classes of porous materials for carbon capture	Huck J.M.;Lin L.-C.;Berger A.H.;Shahrak M.N.;Martin R.L.;Bhown A.S.;Haranczyk M.;Reuter K.;Smit B.; Huck J.M.; Lin L.-C.; Berger A.H.; Shahrak M.N.; Martin R.L.; Bhown A.S.; Haranczyk M.; Reuter K.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	Evaluating different classes of porous materials for carbon capture	Huck J.M.;Lin L.-C.;Berger A.H.;Shahrak M.N.;Martin R.L.;Bhown A.S.;Haranczyk M.;Reuter K.;Smit B.; Huck J.M.; Lin L.-C.; Berger A.H.; Shahrak M.N.; Martin R.L.; Bhown A.S.; Haranczyk M.; Reuter K.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	Reversible CO binding enables tunable CO/H2 and CO/N2 separations in metal-organic frameworks with exposed divalent metal cations	Bloch E.D.;Hudson M.R.;Mason J.A.;Chavan S.;Crocell? V.;Howe J.D.;Lee K.;Dzubak A.L.;Queen W.L.;Zadrozny J.M.;Geier S.J.;Lin L.-C.;Gagliardi L.;Smit B.;Neaton J.B.;Bordiga S.;Brown C.M.;Long J.R.; Bloch E.D.; Hudson M.R.; Mason J.A.; Chavan S.; Crocell? V.; Howe J.D.; Lee K.; Dzubak A.L.; Queen W.L.; Zadrozny J.M.; Geier S.J.; Lin L.-C.; Gagliardi L.; Smit B.; Neaton J.B.; Bordiga S.; Brown C.M.; Long J.R.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:49Z	Reversible CO binding enables tunable CO/H2 and CO/N2 separations in metal-organic frameworks with exposed divalent metal cations	Bloch E.D.;Hudson M.R.;Mason J.A.;Chavan S.;Crocell? V.;Howe J.D.;Lee K.;Dzubak A.L.;Queen W.L.;Zadrozny J.M.;Geier S.J.;Lin L.-C.;Gagliardi L.;Smit B.;Neaton J.B.;Bordiga S.;Brown C.M.;Long J.R.; Bloch E.D.; Hudson M.R.; Mason J.A.; Chavan S.; Crocell? V.; Howe J.D.; Lee K.; Dzubak A.L.; Queen W.L.; Zadrozny J.M.; Geier S.J.; Lin L.-C.; Gagliardi L.; Smit B.; Neaton J.B.; Bordiga S.; Brown C.M.; Long J.R.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Adsorption thermodynamics and intrinsic activation parameters for monomolecular cracking of n-alkanes on br?nsted acid sites in zeolites	Janda A.;Vlaisavljevich B.;Lin L.-C.;Mallikarjun Sharada S.;Smit B.;Head-Gordon M.;Bell A.T.; Janda A.; Vlaisavljevich B.; Lin L.-C.; Mallikarjun Sharada S.; Smit B.; Head-Gordon M.; Bell A.T.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Adsorption thermodynamics and intrinsic activation parameters for monomolecular cracking of n-alkanes on br?nsted acid sites in zeolites	Janda A.;Vlaisavljevich B.;Lin L.-C.;Mallikarjun Sharada S.;Smit B.;Head-Gordon M.;Bell A.T.; Janda A.; Vlaisavljevich B.; Lin L.-C.; Mallikarjun Sharada S.; Smit B.; Head-Gordon M.; Bell A.T.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Small-molecule adsorption in open-site metal-organic frameworks: A systematic density functional theory study for rational design	Lee K.;Howe J.D.;Lin L.-C.;Smit B.;Neaton J.B.; Lee K.; Howe J.D.; Lin L.-C.; Smit B.; Neaton J.B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Small-molecule adsorption in open-site metal-organic frameworks: A systematic density functional theory study for rational design	Lee K.;Howe J.D.;Lin L.-C.;Smit B.;Neaton J.B.; Lee K.; Howe J.D.; Lin L.-C.; Smit B.; Neaton J.B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Water adsorption in metal-organic frameworks with open-metal sites	Peng X.;Lin L.-C.;Sun W.;Smit B.; Peng X.; Lin L.-C.; Sun W.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:48Z	Water adsorption in metal-organic frameworks with open-metal sites	Peng X.;Lin L.-C.;Sun W.;Smit B.; Peng X.; Lin L.-C.; Sun W.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:46Z	Nanoporous Materials Can Tune the Critical Point of a Pure Substance	Braun E.;Chen J.J.;Schnell S.K.;Lin L.-C.;Reimer J.A.;Smit B.; Braun E.; Chen J.J.; Schnell S.K.; Lin L.-C.; Reimer J.A.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:46Z	Nanoporous Materials Can Tune the Critical Point of a Pure Substance	Braun E.;Chen J.J.;Schnell S.K.;Lin L.-C.;Reimer J.A.;Smit B.; Braun E.; Chen J.J.; Schnell S.K.; Lin L.-C.; Reimer J.A.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:46Z	High-throughput computational screening of nanoporous adsorbents for CO2 capture from natural gas	Braun E.;Zurhelle A.F.;Thijssen W.;Schnell S.K.;Lin L.-C.;Kim J.;Thompson J.A.;Smit B.; Braun E.; Zurhelle A.F.; Thijssen W.; Schnell S.K.; Lin L.-C.; Kim J.; Thompson J.A.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:46Z	High-throughput computational screening of nanoporous adsorbents for CO2 capture from natural gas	Braun E.;Zurhelle A.F.;Thijssen W.;Schnell S.K.;Lin L.-C.;Kim J.;Thompson J.A.;Smit B.; Braun E.; Zurhelle A.F.; Thijssen W.; Schnell S.K.; Lin L.-C.; Kim J.; Thompson J.A.; Smit B.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:45Z	Effects of Zeolite Structural Confinement on Adsorption Thermodynamics and Reaction Kinetics for Monomolecular Cracking and Dehydrogenation of n-Butane	Janda A.;Vlaisavljevich B.;Lin L.-C.;Smit B.;Bell A.T.; Janda A.; Vlaisavljevich B.; Lin L.-C.; Smit B.; Bell A.T.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:45Z	Effects of Zeolite Structural Confinement on Adsorption Thermodynamics and Reaction Kinetics for Monomolecular Cracking and Dehydrogenation of n-Butane	Janda A.;Vlaisavljevich B.;Lin L.-C.;Smit B.;Bell A.T.; Janda A.; Vlaisavljevich B.; Lin L.-C.; Smit B.; Bell A.T.; LI-CHIANG LIN
臺大學術典藏	2022-05-24T06:10:45Z	Force Field Development from Periodic Density Functional Theory Calculations for Gas Separation Applications Using Metal-Organic Frameworks	Mercado R.;Vlaisavljevich B.;Lin L.-C.;Lee K.;Lee Y.;Mason J.A.;Xiao D.J.;Gonzalez M.I.;Kapelewski M.T.;Neaton J.B.;Smit B.; Mercado R.; Vlaisavljevich B.; Lin L.-C.; Lee K.; Lee Y.; Mason J.A.; Xiao D.J.; Gonzalez M.I.; Kapelewski M.T.; Neaton J.B.; Smit B.; LI-CHIANG LIN

Showing items 31-55 of 58 (3 Page(s) Totally)
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