Advanced Theory and Simulations
Latest Publications

TOTAL DOCUMENTS

754

(FIVE YEARS 593)

H-INDEX

16

(FIVE YEARS 11)

Published By Wiley (John Wiley & Sons)

2513-0390, 2513-0390

Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Topological Quantum Cathode Materials for Fast Charging Li‐Ion Battery Identified by Machine Learning and First Principles Calculation

Advanced Theory and Simulations ◽

10.1002/adts.202100350 ◽

2022 ◽

pp. 2100350

Author(s):

Wei Wu ◽

Shuo Wang ◽

Qiang Sun

Keyword(s):

Machine Learning ◽

Cathode Materials ◽

First Principles ◽

First Principles Calculation ◽

Li Ion Battery ◽

Topological Quantum ◽

Fast Charging ◽

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Quantum Analog Annealing of Gain‐Dissipative Ising Machine Driven by Colored Gaussian Noise

Advanced Theory and Simulations ◽

10.1002/adts.202100497 ◽

2022 ◽

pp. 2100497

Author(s):

Zhiqiang Liao ◽

Kaijie Ma ◽

Md Shamim Sarker ◽

Siyi Tang ◽

Hiroyasu Yamahara ◽

...

Keyword(s):

Gaussian Noise ◽

Quantum Analog ◽

Colored Gaussian Noise

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Prey Impact Localization Enabled by Material and Structural Interaction in Spider Orb Webs

Advanced Theory and Simulations ◽

10.1002/adts.202100282 ◽

2022 ◽

pp. 2100282

Author(s):

Vinícius F. Dal Poggetto ◽

Federico Bosia ◽

Gabriele Greco ◽

Nicola M. Pugno

Keyword(s):

Structural Interaction ◽

Impact Localization

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Masthead (Adv. Theory Simul. 1/2022)

Advanced Theory and Simulations ◽

10.1002/adts.202270002 ◽

2022 ◽

Vol 5 (1) ◽

pp. 2270002

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5‐Years Anniversary of Advanced Theory and Simulations

Advanced Theory and Simulations ◽

10.1002/adts.202100591 ◽

2022 ◽

Vol 5 (1) ◽

pp. 2100591

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Microscopic Insights into the Effects of Surface Chemistry and Roughness (Adv. Theory Simul. 1/2022)

Advanced Theory and Simulations ◽

10.1002/adts.202270001 ◽

2022 ◽

Vol 5 (1) ◽

pp. 2270001

Author(s):

Mao Wang ◽

John Wang ◽

Jianwen Jiang

Keyword(s):

Surface Chemistry

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Martini 3 Coarse‐Grained Force Field: Small Molecules

Advanced Theory and Simulations ◽

10.1002/adts.202100391 ◽

2021 ◽

pp. 2100391

Author(s):

Riccardo Alessandri ◽

Jonathan Barnoud ◽

Anders S. Gertsen ◽

Ilias Patmanidis ◽

Alex H. de Vries ◽

...

Keyword(s):

Force Field ◽

Small Molecules ◽

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Identifying an Alternative Hydride Transfer Pathway for CO 2 Reduction on CdTe(111) and CuInS 2 (112) Surfaces

Advanced Theory and Simulations ◽

10.1002/adts.202100413 ◽

2021 ◽

pp. 2100413

Author(s):

Lesheng Li ◽

John Mark P. Martirez ◽

Emily A. Carter

Keyword(s):

Hydride Transfer

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Electronic Structure of (Organic‐)Inorganic Metal Halide Perovskites: The Dilemma of Choosing the Right Functional

Advanced Theory and Simulations ◽

10.1002/adts.202100496 ◽

2021 ◽

pp. 2100496

Author(s):

Cecilia Vona ◽

Dmitrii Nabok ◽

Claudia Draxl

Keyword(s):

Electronic Structure ◽

Metal Halide ◽

Halide Perovskites ◽

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A Combined State of Charge Estimation Method for Lithium‐Ion Batteries Using Cubature Kalman Filter and Least Square with Gradient Correction

Advanced Theory and Simulations ◽

10.1002/adts.202100331 ◽

2021 ◽

pp. 2100331

Author(s):

Zheng Liu ◽

Shaohang Chen ◽

Huifeng Wu ◽

Heyue Huang ◽

Zhenhua Zhao

Keyword(s):

Kalman Filter ◽

Lithium Ion Batteries ◽

Estimation Method ◽

Lithium Ion ◽

State Of Charge ◽

Least Square ◽

Cubature Kalman Filter ◽

State Of Charge Estimation ◽

Gradient Correction

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