Edward J. Maginn

机构：University of Notre Dame, Notre Dame de Namur University · ORCID：0000-0002-6309-1347

发表论文 370 篇 · 总被引 29100 次 · h-index 86

代表论文

• Assessing Polymorph Stability and Phase Transitions at Finite Temperature: Integrating Crystal Structure Prediction, Lattice Dynamics, and Molecular Dynamics (2025 · Journal of Chemical Theory and Computation · 被引 3)
• Structure and dynamics of water-in-salt LiTFSI electrolytes from first-principles molecular dynamics simulations (2025 · The Journal of Chemical Physics · 被引 3)
• Structure, dynamics, and electrochemistry of choline chloride/ethylene glycol eutectic solvents at an electrode surface explored by molecular dynamics simulations (2025 · The Journal of Chemical Physics · 被引 2)
• Structure–Property Relationship for the Electrostrictive Properties of Ionic Liquids (2025 · The Journal of Physical Chemistry B · 被引 2)
• Monte Carlo methods, 70 years after “Equation of state calculations by fast computing machines” by Nicholas Metropolis, Arianna Rosenbluth, Marshall Rosenbluth, Augusta Teller, and Edward Teller (1953) (2025 · The Journal of Chemical Physics · 被引 1)
• Active Learning for Transport Property Prediction in CO 2 –Hydrocarbon Systems: A Multifidelity Approach Integrating Molecular Dynamics and Experiments (2025 · Industrial & Engineering Chemistry Research · 被引 1)