Andrey G. Kalinichev

Molecular Models of Hydroxide, Oxyhydroxide, and Clay Phases and the Development of a General Force Field

Randall T. Cygan, Jian-Jie Liang, Andrey G. Kalinichev · The Journal of Physical Chemistry B · 2004 · 3.1K citations

Natural Sciences, Chemistry, Earth Sciences +17

Advances in Clayff Molecular Simulation of Layered and Nanoporous Materials and Their Aqueous Interfaces

Randall T. Cygan, Jeffery A. Greathouse, Andrey G. Kalinichev · The Journal of Physical Chemistry C · 2021 · 322 citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Molecular Dynamics Modeling of Chloride Binding to the Surfaces of Calcium Hydroxide, Hydrated Calcium Aluminate, and Calcium Silicate Phases

Andrey G. Kalinichev, R. James Kirkpatrick · Chemistry of Materials · 2002 · 293 citations

Natural Sciences, Chemistry, Materials Science +15

Molecular dynamics modeling of the structure, dynamics and energetics of mineral–water interfaces: Application to cement materials

Andrey G. Kalinichev, Jianwei Wang, R. James Kirkpatrick · Cement and Concrete Research · 2006 · 282 citations

Natural Sciences, Materials Engineering, Materials Science +16

Molecular models and simulations of layered materials

Randall T. Cygan, Jeffery A. Greathouse, Hendrik Heinz et al. · Journal of Materials Chemistry · 2009 · 277 citations

Natural Sciences, Chemistry, Materials Science +17