Global Structure Optimization of Quadrilateral Meshes

Systematic investigation of how cluster structures change upon interaction with a surface, using global structure optimization by evolutionary algorithms.

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Analytic Approach for Global Structure Optimization of Multiple Quantum Well Solar Cells

2018 IEEE 7th World Conference on Photovoltaic Energy Conversion (WCPEC) (A Joint Conference of 45th IEEE PVSC, 28th PVSEC & 34th EU PVSEC) ◽

10.1109/pvsc.2018.8547872 ◽

2018 ◽

Author(s):

Kasidit Toprasertpong ◽

Yoshiaki Nakano ◽

Masakazu Sugiyama

Keyword(s):

Solar Cells ◽

Quantum Well ◽

Multiple Quantum Well ◽

Structure Optimization ◽

Global Structure ◽

Analytic Approach ◽

Multiple Quantum

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Efficient Global Structure Optimization with a Machine-Learned Surrogate Model

Physical Review Letters ◽

10.1103/physrevlett.124.086102 ◽

2020 ◽

Vol 124 (8) ◽

Cited By ~ 10

Author(s):

Malthe K. Bisbo ◽

Bjørk Hammer

Keyword(s):

Surrogate Model ◽

Structure Optimization ◽

Global Structure

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Global Structure Optimization of Pt Clusters Based on the Modified Empirical Potentials, Calibrated using Density Functional Theory

The Journal of Physical Chemistry C ◽

10.1021/acs.jpcc.9b08691 ◽

2019 ◽

Vol 123 (47) ◽

pp. 29024-29036 ◽

Cited By ~ 3

Author(s):

Stanislav K. Ignatov ◽

Alexey G. Razuvaev ◽

Anastasiia S. Loginova ◽

Artëm E. Masunov

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Structure Optimization ◽

Global Structure ◽

Functional Theory ◽

Empirical Potentials

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The Chemical Nature of Ti4O10–: Vibrational Predissociation Spectroscopy Combined with Global Structure Optimization

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.1c05552 ◽

2021 ◽

Author(s):

Fabian Müller ◽

Joachim Sauer ◽

Xiaowei Song ◽

Knut R. Asmis

Keyword(s):

Chemical Nature ◽

Structure Optimization ◽

Global Structure ◽

Vibrational Predissociation

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DFTB-Assisted Global Structure Optimization of 13- and 55-Atom Late Transition Metal Clusters

The Journal of Physical Chemistry A ◽

10.1021/acs.jpca.9b00927 ◽

2019 ◽

Vol 123 (13) ◽

pp. 3038-3045 ◽

Cited By ~ 16

Author(s):

Maxime Van den Bossche

Keyword(s):

Transition Metal ◽

Metal Clusters ◽

Structure Optimization ◽

Global Structure ◽

Late Transition Metal ◽

Transition Metal Clusters ◽

Late Transition

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