Cosmin A. Dicu-Gohoreanu

most citedHow important is the dielectric constant in water modeling? Evaluation of the performance of the TIP4P/

ε

force field and its compatibility with the Joung-Cheatham NaCl model

9 citations · 9 across the 1 of their papers we have counts for

collaborators

1 paper

cond-mat.soft2025★ 9 cited

How important is the dielectric constant in water modeling? Evaluation of the performance of the TIP4P/ $ε$ force field and its compatibility with the Joung-Cheatham NaCl model

Łukasz Baran, Cosmin A. Dicu-Gohoreanu, Luis G. MacDowell

Efficient large-scale computer simulations of aqueous solutions require the use of accurate but simple empirical force fields for water. However, the complexity of these systems ev…

How important is the dielectric constant in water modeling? Evaluation of the performance of the TIP4P/ε force field and its compatibility with the Joung-Cheatham NaCl model

How important is the dielectric constant in water modeling? Evaluation of the performance of the TIP4P/ $ε$ force field and its compatibility with the Joung-Cheatham NaCl model