Concepedia

Kangyu Yan

KY

3

Publications

269

Citations

3

H-Index

2017

Active since

Affiliations

Beijing National Laboratory for Molecular Sciences(Current)

Peking University

Kangyu Yan is an author at Beijing National Laboratory for Molecular Sciences specializing in natural sciences, molecular design, and biophysics.

Top concepts

PhysicsBiophysicsEngineeringThermodynamicsMolecular DesignNatural SciencesMolecular DynamicsComputational ChemistryEntropyChemistry

Publications per year

2017–2019

3

Publications

3

Unified Efficient Thermostat Scheme for the Canonical Ensemble with Holonomic or Isokinetic Constraints via Molecular Dynamics

Zhijun Zhang, Xinzijian Liu, Kangyu Yan et al. · The Journal of Physical Chemistry A · 2019 · 170 citations

Thermal Fluctuations, Engineering, Thermostat Algorithms +17

A unified thermostat scheme for efficient configurational sampling for classical/quantum canonical ensembles via molecular dynamics

Zhijun Zhang, Xinzijian Liu, Zifei Chen et al. · The Journal of Chemical Physics · 2017 · 86 citations · Full text

Quantum Dynamic, Engineering, Unified Thermostat Scheme +18

A leap-frog algorithm-based efficient unified thermostat scheme for molecular dynamics

Zhijun Zhang, Kangyu Yan, Xinzijian Liu et al. · Chinese Science Bulletin (Chinese Version) · 2018 · 13 citations · Full text

Numerical Analysis, Engineering, Molecular Biology +19

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