Influence of temperature on the capacitance of ionic liquid electrolytes on charged surfaces
Jenel Vatamanu , Lidan Xing , Weishan Li , Dmitry Bedrov
Physical Chemistry Chemical Physics 16 ( 11) 5174 -5182
45
2014
Effect of counter-ion on the thermotropic liquid crystal behaviour of bis(alkyl)-tris(imidazolium salt) compounds
Magdalene R. Schenkel , Justin B. Hooper , Mark J. Moran , Lily A. Robertson
Liquid Crystals 41 ( 11) 1668 -1685
19
2014
Conformations and Chain Dimensions of Poly(ethylene oxide) in Aqueous Solution: A Molecular Dynamics Simulation Study
Grant D. Smith , Dmitry Bedrov , Oleg Borodin
Journal of the American Chemical Society 122 ( 39) 9548 -9549
122
2000
Development of a Polarizable Force Field for Molecular Dynamics Simulations of Poly (Ethylene Oxide) in Aqueous Solution
Oleg N. Starovoytov , Oleg Borodin , Dmitry Bedrov , Grant D. Smith
Journal of Chemical Theory and Computation 7 ( 6) 1902 -1915
25
2011
Structure and Interactions in Micellar Solutions: Molecular Simulations of Pluronic L64 Aqueous Solutions
Dmitry Bedrov , Grant D. Smith , Jinyong Yoon
Langmuir 23 ( 24) 12032 -12041
27
2007
Supramolecular self-organization in PEO-modified C60 fullerene/water solutions: influence of polymer molecular weight and nanoparticle concentration.
Justin B. Hooper , Dmitry Bedrov , Grant D. Smith
Langmuir 24 ( 9) 4550 -4557
42
2008
Role of Plasticity in Mechanical Failure of Solid Electrolyte Interphases on Nanostructured Silicon Electrode: Insight from Continuum Level Modeling
Masatomo Tanaka , Justin B. Hooper , Dmitry Bedrov
ACS Applied Energy Materials 1 ( 5) 1858 -1863
8
2018
Structural and dynamic heterogeneity in a telechelic polymer solution
Dmitry Bedrov , Grant Smith , Jack F. Douglas
Polymer 45 ( 11) 3961 -3966
31
2004
A molecular dynamics simulation study of the influence of free surfaces on the morphology of self-associating polymers
Chakravarthy Ayyagari , Dmitry Bedrov , Grant D. Smith
Polymer 45 ( 13) 4549 -4558
27
2004
Transport mechanism of lithium ions in non-coordinating P(VdF-HFP) copolymer matrix
Lena Mathies , Diddo Diddens , Dengpan Dong , Dmitry Bedrov
Solid State Ionics 357 115497
1
2020
A comparison of self-assembly in lattice and off-lattice model amphiphile solutions
Dmitry Bedrov , Grant D. Smith , Karl F. Freed , Jacek Dudowicz
The Journal of Chemical Physics 116 ( 12) 4765 -4768
11
2002
A molecular dynamics simulation study of crystalline 1,3,5-triamino-2,4,6-trinitrobenzene as a function of pressure and temperature
Dmitry Bedrov , Oleg Borodin , Grant D. Smith , Thomas D. Sewell
The Journal of Chemical Physics 131 ( 22) 224703 -224703
64
2009
Li+ Solvation and Transport Properties in Ionic Liquid/Lithium Salt Mixtures: A Molecular Dynamics Simulation Study
Zhe Li , Grant D Smith , Dmitry Bedrov ,
Journal of Physical Chemistry B 116 ( 42) 12801 -12809
88
2012
Electrode/Electrolyte Interface in Sulfolane-Based Electrolytes for Li Ion Batteries: A Molecular Dynamics Simulation Study
Lidan Xing , Jenel Vatamanu , Oleg Borodin , Grant D. Smith
The Journal of Physical Chemistry C 116 ( 45) 23871 -23881
139
2012
Molecular Dynamics Simulation Study of the Interfacial Structure and Differential Capacitance of Alkylimidazolium Bis(trifluoromethanesulfonyl)imide [Cnmim][TFSI] Ionic Liquids at Graphite Electrodes
Jenel Vatamanu , Oleg Borodin , Dmitry Bedrov , Grant D. Smith
Journal of Physical Chemistry C 116 ( 14) 7940 -7951
106
2012
Grotthuss versus Vehicular Transport of Hydroxide in Anion-Exchange Membranes: Insight from Combined Reactive and Nonreactive Molecular Simulations.
Dengpan Dong , Weiwei Zhang , Adri C. T. van Duin , Dmitry Bedrov
Journal of Physical Chemistry Letters 9 ( 4) 825 -829
63
2018
Exploration of conformational phase space in polymer melts: A comparison of parallel tempering and conventional molecular dynamics simulations
Dmitry Bedrov , Grant D. Smith
The Journal of Chemical Physics 115 ( 3) 1121 -1124
22
2001
A Langevin dynamics simulation study of the tribology of polymer loop brushes
Fang Yin , Dmitry Bedrov , Grant D. Smith , S. Michael Kilbey
Journal of Chemical Physics 127 ( 8) 084910 -084910
15
2007
Bidirectional mapping between self-consistent field theory and molecular dynamics: application to immiscible homopolymer blends.
Thomas D. Sewell , Kim Ø. Rasmussen , Dmitry Bedrov , Grant D. Smith
Journal of Chemical Physics 127 ( 14) 144901 -144901
11
2007
Relationship between the α‐ and β‐relaxation processes in amorphous polymers: Insight from atomistic molecular dynamics simulations of 1,4‐polybutadiene melts and blends
Grant D. Smith , Dmitry Bedrov
Journal of Polymer Science Part B 45 ( 6) 627 -643
71
2007