E. N. Brodskaya, J. C. Eriksson, A. Laaksonen, A. I. Rusanov, “The Pressure Tensor and Local Density Profiles of Computer-simulated Water Clusters”, Mendeleev Commun., 1993, том 3, выпуск 4,страницы 136

Эта публикация цитируется в 5 статьях

The Pressure Tensor and Local Density Profiles of Computer-simulated Water Clusters

E. N. Brodskaya^a, J. C. Eriksson^b, A. Laaksonen^c, A. I. Rusanov^d

^a Department of Chemistry, St. Petersburg State University, St. Petersburg, Russian Federation
^b Department of Physical Chemistry, Royal Institute of Technology, Stockholm, Sweden
^c Department of Physical Chemistry, Arrhemius Laboratory, University of Stockholm, Stockholm, Sweden
^d Mendeleev Center, St. Petersburg State University, St. Petersburg, Russian Federation

Аннотация: For small clusters composed of 125 or more water molecules there is an inner range where the local energy is approximately constant and equal to the bulk phase value whereas the pressure tensor remains anisotropic and has position-dependent components, even for clusters of 256 water molecules.

Язык публикации: английский

DOI: 10.1070/MC1993v003n04ABEH000256