Molecular Dynamics of Polyrotaxane in Solution Investigated by Quasi-Elastic Neutron Scattering and Molecular Dynamics Simulation: Sliding Motion of Rings on Polymer

Neutron Scattering ◽

Dynamics Simulation ◽

Elastic Neutron ◽

Sliding Motion ◽

Elastic Neutron Scattering

Hydrogen motions and the α-relaxation in glass-forming polymers: Molecular dynamics simulation and quasi-elastic neutron scattering results

Pramana ◽

10.1007/bf02704047 ◽

2004 ◽

Vol 63 (1) ◽

pp. 25-32 ◽

Cited By ~ 9

Author(s):

J. Colmenero ◽

A. Arbe ◽

F. Alvarez ◽

A. Narros ◽

D. Richter ◽

...

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Dynamics Simulation ◽

Elastic Neutron ◽

Glass Forming ◽

Elastic Neutron Scattering

Molecular dynamics simulation of quasi-elastic neutron scattering from the fast ion conductor CuI

Physica B Condensed Matter ◽

10.1016/0921-4526(96)00256-6 ◽

1996 ◽

Vol 226 (1-3) ◽

pp. 107-112 ◽

Cited By ~ 4

Author(s):

R.L. McGreevy ◽

J.X.M. Zheng-Johansson ◽

I. Ebbsjö

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Dynamics Simulation ◽

Elastic Neutron ◽

Ion Conductor ◽

Fast Ion Conductor ◽

Fast Ion

Quasi-elastic neutron scattering and molecular dynamics simulation as complementary techniques for studying diffusion in zeolites

Microporous and Mesoporous Materials ◽

10.1016/j.micromeso.2006.12.034 ◽

2007 ◽

Vol 102 (1-3) ◽

pp. 21-50 ◽

Cited By ~ 191

Author(s):

Hervé Jobic ◽

Doros N. Theodorou

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Dynamics Simulation ◽

Elastic Neutron ◽

Complementary Techniques

Molecular dynamics simulation combined with small‐angle X‐ray/neutron scattering defining solution‐state protein structures

Journal of the Chinese Chemical Society ◽

10.1002/jccs.202000498 ◽

2020 ◽

Author(s):

Shang‐Wei Lin ◽

Kuan‐Hsuan Su ◽

Yi‐Qi Yeh ◽

U‐Ser Jeng ◽

Chun‐Ming Wu ◽

...

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Small Angle ◽

Protein Structures ◽

Dynamics Simulation ◽

X Ray ◽

Solution State

Polymer and Water Dynamics in Poly(vinyl alcohol)/Poly(methacrylate) Networks. A Molecular Dynamics Simulation and Incoherent Neutron Scattering Investigation

Polymers ◽

10.3390/polym3041805 ◽

2011 ◽

Vol 3 (4) ◽

pp. 1805-1832 ◽

Cited By ~ 11

Author(s):

Gaio Paradossi ◽

Ivana Finelli ◽

Francesca Natali ◽

Mark T. F. Telling ◽

Ester Chiessi

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Vinyl Alcohol ◽

Water Dynamics ◽

Dynamics Simulation ◽

Poly Vinyl Alcohol ◽

Incoherent Neutron Scattering ◽

Incoherent Neutron

An overview of neutron scattering and molecular dynamics simulation studies of phospholipid bilayers in room-temperature ionic liquid/water solutions

Physica B Condensed Matter ◽

10.1016/j.physb.2018.02.043 ◽

2018 ◽

Vol 551 ◽

pp. 227-231 ◽

Cited By ~ 7

Author(s):

Antonio Benedetto ◽

Pietro Ballone

Keyword(s):

Molecular Dynamics ◽

Ionic Liquid ◽

Neutron Scattering ◽

Liquid Water ◽

Room Temperature ◽

Phospholipid Bilayers ◽

Dynamics Simulation ◽

Simulation Studies ◽

Water Solutions

Na ion dynamics in P2-Nax[Ni1/3Ti2/3]O2: a combination of quasi-elastic neutron scattering and first-principles molecular dynamics study

Journal of Materials Chemistry A ◽

10.1039/d0ta08400j ◽

2020 ◽

Vol 8 (47) ◽

pp. 25290-25297

Author(s):

Qian Chen ◽

Niina H. Jalarvo ◽

Wei Lai

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

First Principles ◽

Md Simulations ◽

First Principle ◽

Ion Dynamics ◽

Elastic Neutron ◽

First Principles Molecular Dynamics

The Na dynamics in P2-Nax[Ni1/3Ti2/3]O2 were investigated through a combination of QENS experiments and first-principle MD simulations.

Investigation of Molecular Dynamics of a PTB7:PCBM Polymer Blend with Quasi-Elastic Neutron Scattering

ACS Applied Polymer Materials ◽

10.1021/acsapm.0c00455 ◽

2020 ◽

Vol 2 (9) ◽

pp. 3797-3804

Author(s):

Dominik Schwaiger ◽

Wiebke Lohstroh ◽

Peter Müller-Buschbaum

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Polymer Blend ◽

Elastic Neutron ◽

Elastic Neutron Scattering

Study of the relaxational and vibrational dynamics of bioprotectant glass-forming mixtures by neutron scattering and molecular dynamics simulation

The Journal of Chemical Physics ◽

10.1063/1.3407428 ◽

2010 ◽

Vol 132 (18) ◽

pp. 184512 ◽

Cited By ~ 25

Author(s):

S. Magazù ◽

F. Migliardo ◽

F. Affouard ◽

M. Descamps ◽

M. T. F. Telling

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Dynamics Simulation ◽

Vibrational Dynamics ◽

Glass Forming

Anisotropic Features of Water and Ion Dynamics in Synthetic Na- and Ca-Smectites with Tetrahedral Layer Charge. A Combined Quasi-elastic Neutron-Scattering and Molecular Dynamics Simulations Study

The Journal of Physical Chemistry C ◽

10.1021/jp304715m ◽

2012 ◽

Vol 116 (31) ◽

pp. 16619-16633 ◽

Cited By ~ 50

Author(s):

Laurent J. Michot ◽

Eric Ferrage ◽

Mónica Jiménez-Ruiz ◽

Martin Boehm ◽

Alfred Delville

Keyword(s):

Molecular Dynamics ◽

Neutron Scattering ◽

Molecular Dynamics Simulations ◽

Layer Charge ◽

Ion Dynamics ◽

Elastic Neutron ◽

Dynamics Simulations ◽

Tetrahedral Layer