Molecular Structure of Poly(methyl methacrylate) Surface II: Effect of Stereoregularity Examined through All-Atom Molecular Dynamics

Kshitij C. Jha; He Zhu; Ali Dhinojwala; Mesfin Tsige

doi:10.1021/la5023328

Molecular Structure of Poly(methyl methacrylate) Surface II: Effect of Stereoregularity Examined through All-Atom Molecular Dynamics

Langmuir ◽

10.1021/la5023328 ◽

2014 ◽

Vol 30 (43) ◽

pp. 12775-12785 ◽

Cited By ~ 17

Author(s):

Kshitij C. Jha ◽

He Zhu ◽

Ali Dhinojwala ◽

Mesfin Tsige

Keyword(s):

Molecular Structure ◽

Molecular Dynamics ◽

Methyl Methacrylate ◽

Poly Methyl Methacrylate

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Molecular Structure of Poly(methyl methacrylate) Surface. I. Combination of Interface-Sensitive Infrared–Visible Sum Frequency Generation, Molecular Dynamics Simulations, and ab Initio Calculations

Langmuir ◽

10.1021/la502333u ◽

2014 ◽

Vol 30 (39) ◽

pp. 11609-11618 ◽

Cited By ~ 30

Author(s):

He Zhu ◽

Kshitij C. Jha ◽

Ram S. Bhatta ◽

Mesfin Tsige ◽

Ali Dhinojwala

Keyword(s):

Molecular Structure ◽

Molecular Dynamics ◽

Methyl Methacrylate ◽

Ab Initio Calculations ◽

Ab Initio ◽

Molecular Dynamics Simulations ◽

Sum Frequency Generation ◽

Poly Methyl Methacrylate ◽

Sum Frequency ◽

Dynamics Simulations

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Molecular structure and vibrational spectra at water/poly(2-methoxyethylacrylate) and water/poly(methyl methacrylate) interfaces: A molecular dynamics simulation study

The Journal of Chemical Physics ◽

10.1063/1.5074144 ◽

2019 ◽

Vol 150 (4) ◽

pp. 044707 ◽

Cited By ~ 5

Author(s):

Sho Kishinaka ◽

Akihiro Morita ◽

Tatsuya Ishiyama

Keyword(s):

Molecular Structure ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Methyl Methacrylate ◽

Simulation Study ◽

Vibrational Spectra ◽

Dynamics Simulation ◽

Poly Methyl Methacrylate

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Molecular structure and glass temperature in surface layers of poly(methyl methacrylate) films. IR spectroscopic study

Polymer Science U S S R ◽

10.1016/0032-3950(91)90263-p ◽

1991 ◽

Vol 33 (3) ◽

pp. 589-596

Author(s):

O.N. Tretinnikov ◽

R.G. Zhbankov

Keyword(s):

Molecular Structure ◽

Methyl Methacrylate ◽

Spectroscopic Study ◽

Glass Temperature ◽

Surface Layers ◽

Poly Methyl Methacrylate ◽

Ir Spectroscopic

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Hydrogen bonding in stereoregular poly(methyl methacrylate)/poly(vinyl chloride) blends as studied by molecular dynamics simulations

Molecular Simulation ◽

10.1080/08927022.2014.899695 ◽

2014 ◽

Vol 41 (7) ◽

pp. 547-554 ◽

Cited By ~ 4

Author(s):

Chaofu Wu

Keyword(s):

Molecular Dynamics ◽

Hydrogen Bonding ◽

Methyl Methacrylate ◽

Molecular Dynamics Simulations ◽

Vinyl Chloride ◽

Poly Methyl Methacrylate ◽

Poly Vinyl Chloride ◽

Dynamics Simulations

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Glass transition and nonlinear mechanical behavior of poly (methyl methacrylate)/carbon nanotubes nanocomposites: A molecular dynamics study

Acta Physica Sinica ◽

10.7498/aps.70.20210752 ◽

2021 ◽

Vol 0 (0) ◽

pp. 0-0

Author(s):

◽

Keyword(s):

Carbon Nanotubes ◽

Molecular Dynamics ◽

Glass Transition ◽

Methyl Methacrylate ◽

Mechanical Behavior ◽

Poly Methyl Methacrylate ◽

Nonlinear Mechanical

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Impregnation of Poly(methyl methacrylate) with Carbamazepine in Supercritical Carbon Dioxide: Molecular Dynamics Simulation

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.0c05657 ◽

2020 ◽

Vol 124 (38) ◽

pp. 8410-8417

Author(s):

Darya L. Gurina ◽

Yury A. Budkov ◽

Mikhail G. Kiselev

Keyword(s):

Carbon Dioxide ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Supercritical Carbon Dioxide ◽

Methyl Methacrylate ◽

Dynamics Simulation ◽

Poly Methyl Methacrylate ◽

Supercritical Carbon

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Local molecular dynamics of poly(ethylene glycol) dimethacrylate synthesized in the presence of branched poly(methyl methacrylate): a photochromic probe study

Russian Chemical Bulletin ◽

10.1007/s11172-009-0152-x ◽

2009 ◽

Vol 58 (6) ◽

pp. 1166-1171

Author(s):

S. V. Kurmaz ◽

V. V. Ozhiganov ◽

M. P. Berezin

Keyword(s):

Molecular Dynamics ◽

Ethylene Glycol ◽

Methyl Methacrylate ◽

Ethylene Glycol Dimethacrylate ◽

Glycol Dimethacrylate ◽

Poly Ethylene Glycol ◽

Poly Methyl Methacrylate ◽

Poly Ethylene

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Temperature and configurational effects on the Young’s modulus of poly (methyl methacrylate): a molecular dynamics study comparing the DREIDING, AMBER and OPLS force fields

Molecular Simulation ◽

10.1080/08927022.2018.1450983 ◽

2018 ◽

Vol 44 (9) ◽

pp. 774-780 ◽

Cited By ~ 4

Author(s):

Iwan H. Sahputra ◽

Alessio Alexiadis ◽

Michael J. Adams

Keyword(s):

Molecular Dynamics ◽

Methyl Methacrylate ◽

Young’S Modulus ◽

Force Fields ◽

Young's Modulus ◽

Poly Methyl Methacrylate

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Effects of blending on the molecular dynamics of highly interacting binary polymer blends of poly(methyl methacrylate) and poly[styrene-co -(maleic anhydride)]

Polymer International ◽

10.1002/pi.4463 ◽

2013 ◽

Vol 62 (11) ◽

pp. 1659-1666

Author(s):

Samy A Madbouly

Keyword(s):

Molecular Dynamics ◽

Maleic Anhydride ◽

Methyl Methacrylate ◽

Polymer Blends ◽

Poly Methyl Methacrylate ◽

Binary Polymer

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Coarse-Grained Molecular Dynamics Analysis of Deformation Mechanisms of Poly(methyl methacrylate) in Nanoimprint Process

Journal of Computational and Theoretical Nanoscience ◽

10.1166/jctn.2015.4106 ◽

2015 ◽

Vol 12 (10) ◽

pp. 3232-3235

Author(s):

Jun Du ◽

Zhengying Wei

Keyword(s):

Molecular Dynamics ◽

Methyl Methacrylate ◽

Deformation Mechanisms ◽

Coarse Grained ◽

Dynamics Analysis ◽

Poly Methyl Methacrylate ◽

Coarse Grained Molecular Dynamics

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