Publications/2018: Difference between revisions

Latest revision as of 07:36, 18 August 2018

Fangfang Dou, Zi-Cai Li, C.S. Chen, and Zhaolu Tian. "Analysis on the method of fundamental solutions for biharmonic equations" Applied Mathematics and Computation 2018 339 346-366 doi:10.1016/j.amc.2018.07.016

Jingang Xiong, Pengfei Jiang, Hui Zheng, and C.S. Chen. "A high accurate simulation of thin plate problems by using the method of approximate particular solutions with high order polynomial basis" Engineering Analysis with Boundary Elements 2018 94 153-158 doi:10.1016/j.enganabound.2018.06.009

Wanru Chang, C.S. Chen, and Wen Li. "Solving fourth order differential equations using particular solutions of Helmholtz-type equations" Applied Mathematics Letters 2018 86 179-185 doi:10.1016/j.aml.2018.06.012

Sanjiv K. Jha, Michael Roth, Guido Todde, J. Paige Buchanan, Robert D. Moser, Manoj K. Shukla, and Gopinath Subramanian. "Role of Stone-Wales defects on the interfacial interactions among graphene, carbon nanotubes, and Nylon 6: A first-principles study" The Journal of Chemical Physics 2018 149, 054703 doi:10.1063/1.5032081

Sanjiv K. Jha, Michael Roth, Guido Todde, J. Paige Buchanan, Robert D. Moser, Manoj K. Shukla, and Gopinath Subramanian. "First-Principles Study of the Interactions between Graphene Oxide and Amine-Functionalized Carbon Nanotube" The Journal of Physical Chemistry C 2018 122 (2), 1288-1298 doi:10.1021/acs.jpcc.7b07502

O’Brien, S.J., T. Miles, C. Pan, M.K. Cambazoglu, I.M. Soto, A.T. Greer, I. Church, L. Quas, M. Legere and J.D. Wiggert. "Particulate Matter Resuspension in Mississippi Bight Assessed with Biophysical Modeling and in situ measurements." presented at 2018 Gulf of Mexico Oil Spill & Ecosystem Science Conference, New Orleans, Louisiana, 5-8 February.

Schmidt, Bjorn V. and Schaefer, Jacob. "Ecological and landscape effects on genetic distance in an assemblage of headwater fishes". Ecology of Freshwater Fish 2018 27, 617-631 doi:10.1111/eff.12375

Schmidt, B. V. and Schaefer, J. F. "Comparative genetic isolation patterns for multiple headwater fishes in three geographic regions". Journal of Fish Biology 2018 92, 1090-1109 doi:10.1111/jfb.13570

Subramanian, Gopinath "Parallel Replica Dynamics of Bead‐Spring Elastomers at Low Strain Rates". Macromolecular Theory and Simulations. In Press. doi:10.1002/mats.201800010

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-* [mailto:gopinath.subramanian@usm.edu Subramanian, Gopinath] "Parallel Replica Dynamics of Bead‐Spring Elastomers at Low Strain Rates". ''Macromolecular Theory and Simulations''. In Press. doi:[//doi.org/10.1002/mats.201800010 10.1002/mats.201800010 ]
+* Fangfang Dou, Zi-Cai Li, C.S. Chen, and [mailto:tianzhaolu2004@126.com Zhaolu Tian]. "Analysis on the method of fundamental solutions for biharmonic equations" ''Applied Mathematics and Computation'' 2018 339 346-366 doi:[//doi.org/10.1016/j.amc.2018.07.016 10.1016/j.amc.2018.07.016]
-** A new application of the recently developed superbasin‐parallel replica (ParRep) method is presented. As a demonstration of this new application, mechanical properties of elastomeric networks of Lennard‐Jones polymer chains are calculated. In this application, superbasin boundaries are placed at locations in phase space corresponding to chain breakage. It is shown that placing superbasin boundaries at this natural location satisfies the prerequisites for using superbasin‐ParRep, and for the simulations conducted, leads to a near‐ideal scaling of wall clock time with the number of replicas, thereby demonstrating the potential for a drastic extension of simulation timescales for this class of systems.
+* Jingang Xiong, Pengfei Jiang, [mailto:zhenghui@ncu.edu.cn Hui Zheng], and C.S. Chen. "A high accurate simulation of thin plate problems by using the method of approximate particular solutions with high order polynomial basis" ''Engineering Analysis with Boundary Elements'' 2018 94 153-158 doi:[//doi.org/10.1016/j.enganabound.2018.06.009 10.1016/j.enganabound.2018.06.009]
+* Wanru Chang, [mailto:cschen.math@gmail.com C.S. Chen], and [mailto:liw2@clarkson.edu Wen Li]. "Solving fourth order differential equations using particular solutions of Helmholtz-type equations" ''Applied Mathematics Letters'' 2018 86 179-185 doi:[//doi.org/10.1016/j.aml.2018.06.012 10.1016/j.aml.2018.06.012]
+*  [mailto:sjha@ecok.edu Sanjiv K. Jha], Michael Roth, Guido Todde, J. Paige Buchanan, Robert D. Moser, [mailto:Manoj.K.Shukla@usace.army.mil Manoj K. Shukla], and Gopinath Subramanian. "Role of Stone-Wales defects on the interfacial interactions among graphene, carbon nanotubes, and Nylon 6: A first-principles study" ''The Journal of Chemical Physics'' 2018 149, 054703 doi:[//doi.org/10.1063/1.5032081 10.1063/1.5032081]
 * [mailto:sjha@samford.edu Sanjiv K. Jha], Michael Roth, Guido Todde, J. Paige Buchanan, Robert D. Moser, Manoj K. Shukla, and [mailto:gopinath.subramanian@usm.edu Gopinath Subramanian]. "First-Principles Study of the Interactions between Graphene Oxide and Amine-Functionalized Carbon Nanotube" ''The Journal of Physical Chemistry C'' 2018 122 (2), 1288-1298 doi:[//doi.org/10.1021/acs.jpcc.7b07502 10.1021/acs.jpcc.7b07502]
-** We applied plane-wave density functional theory to study the effects of chemical functionalizations of graphene and carbon nanotube (CNT) on the properties of graphene–CNT complexes. The functionalizations of graphene and CNT were modeled by covalently attaching oxygen-containing groups and amines (NH2), respectively, to the surfaces of these carbon nanomaterials. Our results show that both dispersion energy and hydrogen bonding play crucial roles in the formation of complexes between graphene oxide (GO) and CNT–NH2. At a lesser degree of functionalization, the interaction energies between functionalized graphene and CNT were either unchanged or decreased, with respect to those without functionalization. Our study indicated that the gain or loss of interaction energy between graphene and CNT is a competition between two contributions: dispersion energy and hydrogen bonds. It was found that the heavy functionalization of graphene and CNT could be a promising route for enhancing the interaction energy between them. Specifically, the carboxyl-functionalized GO produced the greatest increase in the hydrogen bond strength relative to the dispersion energy loss. The influence of Stone–Wales defects in CNT on the computed interaction energies was also examined. The computed electron density difference maps revealed that the enhancement in the interaction energy is due to the formation of several hydrogen bonds between oxygen-containing groups of GO and NH2-groups of CNT. Our results show that Young’s moduli of carbon nanomaterials decrease with the increasing concentration of functional groups. The moduli of GO–CNT–NH2 complexes were found to be the averages of the moduli of their constituents.
+* O’Brien, S.J., T. Miles, C. Pan, M.K. Cambazoglu, I.M. Soto, A.T. Greer, I. Church, L. Quas, M. Legere and J.D. Wiggert. "Particulate Matter Resuspension in Mississippi Bight Assessed with Biophysical Modeling and in situ measurements."  presented at 2018 Gulf of Mexico Oil Spill & Ecosystem Science Conference, New Orleans, Louisiana, 5-8 February.
+* Schmidt, Bjorn V. and Schaefer, Jacob. "Ecological and landscape effects on genetic distance in an assemblage of headwater fishes". ''Ecology of Freshwater Fish'' 2018 27, 617-631 doi:[//doi.org/10.1111/eff.12375 10.1111/eff.12375]
+* Schmidt, B. V. and Schaefer, J. F. "Comparative genetic isolation patterns for multiple headwater fishes in three geographic regions". ''Journal of Fish Biology'' 2018 92, 1090-1109 doi:[//doi.org/10.1111/jfb.13570 10.1111/jfb.13570]
+* [mailto:gopinath.subramanian@usm.edu Subramanian, Gopinath] "Parallel Replica Dynamics of Bead‐Spring Elastomers at Low Strain Rates". ''Macromolecular Theory and Simulations''. In Press. doi:[//doi.org/10.1002/mats.201800010 10.1002/mats.201800010 ]