Showing results (1411-1420 of 11,387) with videos related to
Sort By:
Pageof 1,139
Journal of Chemical Theory and Computation|November 26, 2015
Interactions and Ordering of Ionic Liquids at a Metal SurfaceAna C F Mendonça, Patrice Malfreyt, Agílio A H PáduaJournal of Chemical Theory and Computation|November 26, 2015
Coarse-Grained Structure-Based Model for RNA-Protein Complexes Developed by Fluctuation MatchingNaoto Hori, Shoji TakadaJournal of Chemical Theory and Computation|November 26, 2015
Comparative Study on the Performance of Hybrid DFT Functionals in Highly Correlated Oxides: The Case of CeO2 and Ce2O3Jesús Graciani, Antonio M Márquez, José J Plata, et al.Journal of Chemical Theory and Computation|November 26, 2015
Designing a Scalable Fault Tolerance Model for High Performance Computational Chemistry: A Case Study with Coupled Cluster Perturbative TriplesHubertus J J van Dam, Abhinav Vishnu, Wibe A de JongJournal of Chemical Theory and Computation|November 26, 2015
Weak Molecular Interactions Studied with Parallel Implementations of the Local Pair Natural Orbital Coupled Pair and Coupled Cluster MethodsDimitrios G Liakos, Andreas Hansen, Frank NeeseJournal of Chemical Theory and Computation|November 26, 2015
Assessment of the Performance of DFT and DFT-D Methods for Describing Distance Dependence of Hydrogen-Bonded InteractionsKanchana S Thanthiriwatte, Edward G Hohenstein, Lori A Burns, et al.Journal of Chemical Theory and Computation|November 26, 2015
G4(MP2)-6X: A Cost-Effective Improvement to G4(MP2)Bun Chan, Jia Deng, Leo RadomJournal of Chemical Theory and Computation|November 26, 2015
Accurate Vibrational Frequencies of Borane and Its IsotopologuesPatrick Meier, Michael Neff, Guntram RauhutJournal of Chemical Theory and Computation|November 26, 2015
Molecular Dynamics Simulations Predict a Favorable and Unique Mode of Interaction between Lithium (Li(+)) Ions and Hydrophobic Molecules in Aqueous SolutionAndrew S Thomas, Adrian H ElcockJournal of Chemical Theory and Computation|November 26, 2015
Can Electron-Rich π Systems Bind Anions?Inacrist Geronimo, N Jiten Singh, Kwang S KimPageof 1,139