An ab initio parametrized interatomic force field for silica

By Paul Tangney, S. Scandolo. 2002

210 citations recorded by the source corpus.

Subfields: Ceramics and Composites, Geophysics, Materials Chemistry

View Paper: https://www.semanticscholar.org/paper/be44f0a731c0bde892f9c4718a0e63e4815a259e

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Ceramics and Composites

1. N. Sator
2. B. Guillot

In Geophysics

1. James R. Kermode
2. N. Sator
3. Peter Gumbsch
4. B. Guillot
5. E. Bitzek

In Materials Chemistry

1. James R. Kermode
2. E. Bitzek
3. N. Sator
4. Peter Gumbsch
5. B. Guillot
6. Alexander V. Shapeev

Citations in the corpus

• Atomistic aspects of fracture (2015, background): “…accurate polarisable interatomic potentials for oxides have been developed which coarse-grain electronic degrees of freedom, replacing them with dipole moments determined selfconsistently in response to the local electric field (Tangney and Scandolo 2002; Brommer et al. 2010; Kermode et al. 2010).”
• A computer simulation study of natural silicate melts. Part I: Low pressure properties (2007, background): “This simple ansatz allows to evaluate with a good accuracy the elastic constants of the crystalline polymorphs of silica (Tsuneyuki et al., 1990; Herzbach et al., 2005), or to investigate the behavior of liquid silica under pressure (Rustad et al., 1990; Tangney and Scandolo, 2002), for instance.”