Structures and Photoelectron Spectroscopies of Si2C2-Studied with ab Initio Multicanonical Monte Carlo Simulation

Pradipta Bandyopadhyay; Seiichiro Ten-no; Suehiro Iwata

doi:10.1021/jp991004x

Structures and Photoelectron Spectroscopies of Si2C2-Studied with ab Initio Multicanonical Monte Carlo Simulation

The Journal of Physical Chemistry A ◽

10.1021/jp991004x ◽

1999 ◽

Vol 103 (32) ◽

pp. 6442-6447

Author(s):

Pradipta Bandyopadhyay ◽

Seiichiro Ten-no ◽

Suehiro Iwata

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Ab Initio

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Ceramics International ◽

10.1016/j.ceramint.2021.08.074 ◽

2021 ◽

Author(s):

O. Mounkachi ◽

L. Fkhar ◽

R. Lamouri ◽

E. Salmani ◽

A. El hat ◽

...

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Magnetic Properties ◽

Ab Initio ◽

Magnetoresistance Effect ◽

Spinel Nanoparticles

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10.1109/intercon.2018.8526433 ◽

2018 ◽

Cited By ~ 1

Author(s):

Huber Nieto-Chaupis

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Ab Initio

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Optical and Quantum Electronics ◽

10.1007/s11082-017-0932-8 ◽

2017 ◽

Vol 49 (3) ◽

Cited By ~ 1

Author(s):

El Mehdi Salmani ◽

Ayoub Laghrissi ◽

Rachida Lamouri ◽

Mustapha Dehmani ◽

El Mostafa Benchafia ◽

...

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Magnetic Properties ◽

Ab Initio Calculations ◽

Ab Initio ◽

Mean Field ◽

Field Approximation ◽

Mean Field Approximation ◽

Optical And Magnetic Properties ◽

Doped Titania

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The Journal of Chemical Physics ◽

10.1063/1.1579671 ◽

2003 ◽

Vol 119 (2) ◽

pp. 947-952 ◽

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Author(s):

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Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Thermodynamic Properties ◽

Ab Initio ◽

Interaction Potentials

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The Journal of Physical Chemistry C ◽

10.1021/jp805559a ◽

2008 ◽

Vol 112 (43) ◽

pp. 16725-16728 ◽

Cited By ~ 28

Author(s):

George P. Lithoxoos ◽

Jannis Samios ◽

Yannick Carissan

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Hydrogen Storage ◽

Ab Initio ◽

Simulation Study ◽

Potential Candidate ◽

Grand Canonical Monte Carlo ◽

Monte Carlo Simulation Study ◽

Grand Canonical

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Journal of Power Sources ◽

10.1016/j.jpowsour.2014.09.004 ◽

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Cited By ~ 22

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Byeongchan Lee ◽

Maenghyo Cho ◽

Kyeongjae Cho

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Ab Initio ◽

Amorphous Silicon ◽

Simulation Study ◽

Kinetic Monte Carlo ◽

Monte Carlo Simulation Study ◽

Kinetic Monte Carlo Simulation

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10.1021/jp952839k ◽

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Enrique Sánchez Marcos

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Aqueous Solutions ◽

Ab Initio ◽

Highly Charged Ions ◽

Intermolecular Potential ◽

Charged Ions ◽

Hydrated Ion

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Efficient sampling for ab initio Monte Carlo simulation of molecular clusters using an interpolated potential energy surface

The Journal of Chemical Physics ◽

10.1063/1.3055910 ◽

2009 ◽

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Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Potential Energy ◽

Potential Energy Surface ◽

Ab Initio ◽

Energy Surface ◽

Molecular Clusters ◽

Efficient Sampling

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Author(s):

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Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Carbon Nanotube ◽

Ab Initio ◽

Anticancer Drug

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Vol 1 (6) ◽

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Author(s):

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Wagner B. De Almeida

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Carbon Tetrachloride ◽

Transition State ◽

Ab Initio ◽

Gas Phase ◽

Simulation Study ◽

Transition State Theory ◽

State Theory ◽

Monte Carlo Simulation Study

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