Search Results

• Stick-Slip Motion of Moving Contact Line on Chemically Patterned Surfaces

  Congmin Wu, Siulong Lei, Tiezheng Qian, Xiaoping Wang

  2010-07-01

  40416 4036 Pages:403-422

• Computational Software: Polymer Chain Generation for Coarse-Grained Models Using Radical-Like Polymerization

  Morgane Mahaud, Zengqiang Zhai, Michel Perez, Olivier Lame, Claudio Fusco, Laurent Chazeau, Ali Makke, Grégory Marque, Julien Morthomas

  2018-09-17

  51739 5343 Pages:885-898 Open-access

• Liquid Fuel Evaporation under Supercritical Conditions

  Guowei Xiao, Kai Hong Luo, Xiao Ma, Shijin Shuai

  2020-07-31

  49519 3258 Pages:1241-1262

• Investigating the Selectivity of KcsA Channel by an Image Charge Solvation Method (ICSM) in Molecular Dynamics Simulations

  Katherine Baker, Duan Chen, Wei Cai

  2018-04-04

  40484 3359 Pages:927-943

• Molecular Dynamics Simulation of Bombardment of Hydrogen Atoms on Graphite Surface

  A. Ito, H. Nakamura

  2008-09-05

  39225 3932 Pages:592-610

• Effect of the Reaction Field on Molecular Forces and Torques Revealed by an Image-Charge Solvation Model

  Wei Song, Yuchun Lin, Andrij Baumketner, Shaozhong Deng, Wei Cai, Donald J. Jacobs

  2013-01-05

  41315 4493 Pages:129-149

• A Dynamical Concurrent Multiscale Method Employing a Transmitting Boundary to Minimize Wave Reflections at the Domain Interface

  Abhishek Vishwanath Rammohan, Vincent Beng Chye Tan

  2020-02-23

  46518 3134 Pages:1115-1139

• Extended BGK Boltzmann for Dense Gases

  Saikishan Suryanarayanan, Shiwani Singh, Santosh Ansumali

  2020-07-31

  41189 4297 Pages:629-648

• Quantum Chemical Calculations of Warfarin Sodium, Warfarin and Its Metabolites

  Emine Deniz (Calisir) Tekin, Figen Erkoc, Ilkay Yildiz, Sakir Erkoc

  2008-04-01

  38743 4735 Pages:161-176

• Computer Simulation of Two Component Dense Plasma by Molecular Dynamics Method

  Zh. A. Moldabekov, T. S. Ramazanov

  2020-07-31

  40870 3919 Pages:1159-1166

• An Efficient Hybrid DSMC/MD Algorithm for Accurate Modeling of Micro Gas Flows

  Tengfei Liang, Wenjing Ye

  2014-01-05

  40713 4643 Pages:246-264

• Prospective Merger Between Car-Parrinello and Lattice Boltzmann Methods for Quantum Many-Body Simulations

  Sauro Succi, Silvia Palpacelli

  2020-07-21

  39548 3692 Pages:1137-1151

• Numerical Study of the Isotropic-Nematic Phase Transition in Liquid Crystals Using the String Method

  Yunzhi Li, Weiqing Ren

  2018-08-21

  46281 3833 Pages:1534-1548

• A Quadrature-Based Kinetic Model for Dilute Non-Isothermal Granular Flows

  Alberto Passalacqua, Janine E. Galvin, Prakash Vedula, Christine M. Hrenya, Rodney O. Fox

  2011-10-01

  38903 4449 Pages:216-252

• Dynamical Coupling Atomistic and Continuum Simulations

  Guowu Ren, Dier Zhang, Xin-Gao Gong

  2011-10-01

  38502 3945 Pages:1305-1314

• Computer Simulation of Helium Effects in Plutonium During the Aging Process of Self-Radiation Damage

  Bingyun Ao, Piheng Chen, Peng Shi, Xiaolin Wang, Wangyu Hu, Liang Wang

  2020-07-31

  39582 3932 Pages:1205-1225

• A Consistency Study of Coarse-Grained Dynamical Chains through a Nonlinear Wave Equation of Mixed Type

  Mingjie Liao, Ping Lin

  2020-07-30

  43538 3629 Pages:921-948

• Adapted Nested Force-Gradient Integrators: The Schwinger Model Case

  Dmitry Shcherbakov, Matthias Ehrhardt, Jacob Finkenrath, Michael Guenther, Francesco Knechtli, Michael Peardon

  2018-04-09

  43303 3204 Pages:1141-1153

• Mathematical and Numerical Aspects of the Adaptive Fast Multipole Poisson-Boltzmann Solver

  Bo Zhang, Benzhuo Lu, Xiaolin Cheng, Jingfang Huang, Nikos P. Pitsianis, Xiaobai Sun, J. Andrew McCammon

  2013-01-05

  41137 4484 Pages:107-128

• The Modern Information Technologies and Visualization Methods for Analysis of Computer Simulation Results for Complex Plasma

  T. S. Ramazanov, S. K. Kodanova, M. K. Issanova, N. Kh. Bastykova, Zh. A. Moldabekov

  2020-07-31

  41327 4025 Pages:981-995

• DelEnsembleElec: Computing Ensemble-Averaged Electrostatics Using DelPhi

  Lane W. Votapka, Luke Czapla, Maxim Zhenirovskyy, Rommie E. Amaro

  2013-01-05

  41122 4502 Pages:256-268

• Reconstruction of Dynamical Systems Without Time Label

  Zhijun Zeng, Chenglong Bao, Pipi Hu, Yi Zhu, Zuoqiang Shi

  2026-01-03

  1938 111 Pages:941-968

• Simulation of Impurity Diffusion in a Strained Nanowire Using Off-Lattice KMC

  Weidong Guo, Tim P. Schulze, E. Weinan

  2007-02-01

  38790 4361 Pages:164-176

• Heterogeneous Multiscale Methods: A Review

  Weinan E, Bjorn Engquist, Xiantao Li, Weiqing Ren, Eric Vanden-Eijnden

  2007-02-01

  47704 5512 Pages:367-450 Open-access

• Towards Translational Invariance of Total Energy with Finite Element Methods for Kohn-Sham Equation

  Gang Bao, Guanghui Hu, Di Liu

  2018-04-03

  41774 4774 Pages:1-23

• MD Simulation of Structural and Mechanical Transformation of Single-Walled Carbon Nanotubes Under Pressure

  Ji Zang, Oswaldo Aldas-Palacios, Feng Liu

  2007-02-01

  38492 4263 Pages:451-465

• On Applicability of Poisson-Boltzmann Equation for Micro- and Nanoscale Electroosmotic Flows

  Moran Wang, Shiyi Chen

  2008-03-01

  40168 4215 Pages:1087-1099