발행물

전체 논문

276

261

Understanding the effect of side groups in ionic liquids on carbon-capture properties: a combined experimental and theoretical effort
Yan, FY[Yan, Fangyong], Lartey, M[Lartey, Michael], Damodaran, K[Damodaran, Krishn, Albenze, E[Albenze, Erik], Thompson, RL[Thompson, Robert, Kim, J[Kim, Jihan], Haranczyk, M[Haranczyk, Maciej, Nulwala, HB[Nulwala, Hunaid B., Luebke, DR[Luebke, David R.], Smit, B[Smit, Berend]
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2013

262

Understanding CO2 Dynamics in Metal-Organic Frameworks with Open Metal Sites
Lin, LC[Lin, Li-Chiang], Kim, J[Kim, Jihan], Kong, XQ[Kong, Xueqian], Scott, E[Scott, Eric], McDonald, TM[McDonald, Thomas, Long, JR[Long, Jeffrey R.], Reimer, JA[Reimer, Jeffrey A.], Smit, B[Smit, Berend]
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2013

263

Predicting Large CO2 Adsorption in Aluminosilicate Zeolites for Postcombustion Carbon Dioxide Capture
Kim, J[Kim, Jihan], Lin, LC[Lin, Li-Chiang], Swisher, JA, Haranczyk, M, Smit, B[Smit, Berend]
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 201211

264

Similarity-Driven Discovery of Zeolite Materials for Adsorption-Based Separations
Martin, RL[Martin, Richard L.], Willems, TF[Willems, Thomas F., Lin, LC[Lin, Li-Chiang], Kim, J[Kim, Jihan], Swisher, JA[Swisher, Joseph A., Smit, B[Smit, Berend], Haranczyk, M[Haranczyk, Maciej
CHEMPHYSCHEM, 201211

265

Ab initio carbon capture in open-site metal-organic frameworks
Dzubak, AL[Dzubak, Allison L.], Lin, LC[Lin, Li-Chiang], Kim, J[Kim, Jihan], Swisher, JA, Poloni, R[Poloni, Roberta], Maximoff, SN, Smit, B[Smit, Berend], Gagliardi, L[Gagliardi, Laura]
NATURE CHEMISTRY, 201210

266

Large-Scale Computational Screening of Zeolites for Ethane/Ethene Separation
Kim, J[Kim, Jihan], Lin, LC[Lin, Li-Chiang], Martin, RL[Martin, Richard L.], Swisher, JA, Smit, B[Smit, Berend], Haranczyk, M
LANGMUIR, 201208

267

Efficient Monte Carlo Simulations of Gas Molecules Inside Porous Materials
Kim, J[Kim, Jihan], Smit, B[Smit, Berend]
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 201207

268

In silico screening of carbon-capture materials
Lin, LC[Lin, Li-Chiang], Berger, AH[Berger, Adam H.], Martin, RL[Martin, Richard L.], Kim, J[Kim, Jihan], Swisher, JA, Jariwala, K[Jariwala, Kuldeep], Rycroft, CH[Rycroft, Chris H.], Bhown, AS[Bhown, Abhoyjit S.], Deem, M[Deem, MichaelW.], Haranczyk, M, Smit, B[Smit, Berend]
NATURE MATERIALS, 201207

269

High-Throughput Characterization of Porous Materials Using Graphics Processing Units
Kim, J[Kim, Jihan], Martin, RL[Martin, Richard L.], Rubel, O[Ruebel, Oliver], Haranczyk, M[Haranczyk, Maciej, Smit, B
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 201205

270

Molecular Monte Carlo Simulations Using Graphics Processing Units: To Waste Recycle or Not?
Kim, J[Kim, Jihan], Rodgers, JM[Rodgers, Jocelyn M, Athenes, M[Athenes, Manuel], Smit, B[Smit, Berend]
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 201110