scholarly journals Ab initio simulation study of defect assisted Zener tunneling in GaAs diode

AIP Advances ◽  
2017 ◽  
Vol 7 (6) ◽  
pp. 065302 ◽  
Author(s):  
Juan Lu ◽  
Zhi-Qiang Fan ◽  
Jian Gong ◽  
Xiang-Wei Jiang
Keyword(s):  
Ab Initio ◽  
Simulation Study ◽  
Ab Initio Simulation ◽  
Zener Tunneling

scholarly journals Neutron Brillouin scattering and ab initio simulation study of the collective dynamics of liquid silver

2020 ◽  
Vol 102 (5) ◽  
Author(s):  
Eleonora Guarini ◽  
Alessio De Francesco ◽  
Ubaldo Bafile ◽  
Alessio Laloni ◽  
Beatriz G. del Rio ◽  
...  
Keyword(s):  
Ab Initio ◽  
Simulation Study ◽  
Brillouin Scattering ◽  
Ab Initio Simulation ◽  
Liquid Silver ◽  
Collective Dynamics

Cluster Formation in Sodium-Doped Zeolite Y: Ab-Initio Simulation Study

1995 ◽  
Vol 99 (17) ◽  
pp. 6697-6714 ◽  
Author(s):  
C. P. Ursenbach ◽  
P. A. Madden ◽  
I. Stich ◽  
M. C. Payne
Keyword(s):  
Ab Initio ◽  
Simulation Study ◽  
Zeolite Y ◽  
Cluster Formation ◽  
Ab Initio Simulation

scholarly journals Stretching and breaking of PEO nanofibres. A classical force field and ab initio simulation study

Soft Matter ◽  
2020 ◽  
Vol 16 (11) ◽  
pp. 2736-2752 ◽  
Author(s):  
Eivind Bering ◽  
Astrid S. de Wijn
Keyword(s):  
Mechanical Properties ◽  
Force Field ◽  
Ab Initio ◽  
Simulation Study ◽  
Ab Initio Simulation

Nanometric bundles are considered in nearly atomistic detail, studying the effect of chain–chain interactions on the mechanical properties.

Hydrolysis of tetravalent group IV metal ions: an ab initio simulation study

2010 ◽  
Vol 12 (39) ◽  
pp. 12423 ◽  
Author(s):  
Len Herald V. Lim ◽  
Anirban Bhattacharjee ◽  
Bernhard R. Randolf ◽  
Bernd M. Rode
Keyword(s):  
Metal Ions ◽  
Ab Initio ◽  
Simulation Study ◽  
Group Iv ◽  
Ab Initio Simulation ◽  
Hydrolysis Of
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