-
Interatomic potentials are
mathematical functions to
calculate the
potential energy of a
system of
atoms with
given positions in space.
Interatomic potentials...
- Machine-learned
interatomic potentials (MLIPs), or
simply machine learning potentials (MLPs), are
interatomic potentials constructed by
machine learning...
-
direct result of
interatomic interaction, it is
related to the extension/compression of bonds. It can then be
derived from the
interatomic potential for...
-
Interatomic Coulombic decay (ICD) is a general,
fundamental property of
atoms and
molecules that have neighbors.
Interatomic (intermolecular) Coulombic...
- A
chemical bond is the ****ociation of
atoms or ions to form molecules, crystals, and
other structures. The bond may
result from the
electrostatic force...
- directional,
stronger than a van der
Waals force interaction,
produces interatomic distances shorter than the sum of
their van der
Waals radii, and usually...
- the
helium atoms.
These interatomic forces in
helium are weak to
begin with
because helium is a
noble gas, but the
interatomic attractions are reduced...
- The Open
Knowledgebase of
Interatomic Models (OpenKIM). is a
cyberinfrastructure funded by the
United States National Science Foundation (NSF) focused...
-
Physical constant providing length scale to
interatomic interactions...
- D. (1976). "Revised
effective ionic radii and
systematic studies of
interatomic distances in
halides and chalcogenides" (PDF). Acta Crystallographica...
