المؤلفون: Sengupta, Soumyadipta, Pant, Rakesh, Venkatnathan, Arun, Lyulin, Alexey V.

المصدر: Sengupta , S , Pant , R , Venkatnathan , A & Lyulin , A V 2022 , ' Molecular-Dynamics Modeling of Nafion Membranes ' , Macromolecular Symposia , vol. 405 , no. 1 , 2100212 . https://doi.org/10.1002/masy.202100212

مصطلحات موضوعية: molecular dynamics simulations, Nafion, polyelectrolyte membrane

وصف الملف: application/pdf

الاتاحة: https://research.tue.nl/en/publications/11ae3e31-1e6f-4fdb-bebc-685ce81a8f5e
https://doi.org/10.1002/masy.202100212
https://pure.tue.nl/ws/files/230742269/Macromolecular_Symposia_2022_Sengupta_Molecular_Dynamics_Modeling_of_Nafion_Membranes_1.pdf
http://www.scopus.com/inward/record.url?scp=85140266182&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta

المصدر: Sengupta , S 2020 , ' In silico investigation of structure, dynamics and interfaces of polyelectrolyte membranes for fuel cells and flow batteries ' , Doctor of Philosophy , Applied Physics and Science Education , Eindhoven .

وصف الملف: application/pdf

Relation: https://research.tue.nl/en/publications/77a963cd-0e85-4721-a41d-cd8e2406bdc5; urn:ISBN:978-90-386-5075-3

الاتاحة: https://research.tue.nl/en/publications/77a963cd-0e85-4721-a41d-cd8e2406bdc5
https://pure.tue.nl/ws/files/160360028/20200910_Sengupta.pdf

المؤلفون: Lyulin, Alexey V., Sengupta, Soumyadipta, Varughese, Anna, Komarov, Pavel, Venkatnathan, Arun

المصدر: Lyulin , A V , Sengupta , S , Varughese , A , Komarov , P & Venkatnathan , A 2020 , ' Effect of Annealing on Structure and Diffusion in Hydrated Nafion Membranes ' , ACS Applied Polymer Materials , vol. 2 , no. 11 , pp. 5058-5066 . https://doi.org/10.1021/acsapm.0c00875

مصطلحات موضوعية: aging, glass transition, molecular dynamics simulation, Nafion, polyelectrolyte membrane

الاتاحة: https://research.tue.nl/en/publications/8c8faeb3-fe5d-45b7-a178-5705eda998b3
https://doi.org/10.1021/acsapm.0c00875
http://www.scopus.com/inward/record.url?scp=85097556879&partnerID=8YFLogxK

المؤلفون: Pant, Rakesh, Sengupta, Soumyadipta, Lyulin, Alexey V., Venkatnathan, Arun

المصدر: Pant , R , Sengupta , S , Lyulin , A V & Venkatnathan , A 2020 , ' Computational investigation of a protic ionic liquid doped poly-benzimidazole fuel cell electrolyte ' , Journal of Molecular Liquids , vol. 314 , 113686 . https://doi.org/10.1016/j.molliq.2020.113686

مصطلحات موضوعية: Diffusion coefficient, Ionic conductivity, Ionic liquids, Molecular dynamics, Radial distribution function

الاتاحة: https://research.tue.nl/en/publications/86a4fa3a-78cd-41c1-bf5a-b7e0741fd5f6
https://doi.org/10.1016/j.molliq.2020.113686
http://www.scopus.com/inward/record.url?scp=85087385289&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Lyulin, Alexey

المصدر: Sengupta , S & Lyulin , A 2020 , ' Dissipative particle dynamics modeling of polyelectrolyte membrane-water interfaces ' , Polymers , vol. 12 , no. 4 , 907 . https://doi.org/10.3390/polym12040907

مصطلحات موضوعية: Cluster, Dissipative particle dynamics (DPD), Interface, Polyelectrolyte, Water uptake

وصف الملف: application/pdf

الاتاحة: https://research.tue.nl/en/publications/b1437ebc-1ff5-4c32-87e4-735da4377c6f
https://doi.org/10.3390/polym12040907
https://pure.tue.nl/ws/files/149744267/polymers_12_00907.pdf
http://www.scopus.com/inward/record.url?scp=85084570383&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Lyulin, Alexey V.

المصدر: Sengupta , S & Lyulin , A V 2019 , ' Molecular modelling of structure and dynamics of nafion protonation states ' , Journal of Physical Chemistry B , vol. 123 , no. 31 , pp. 6882-6891 . https://doi.org/10.1021/acs.jpcb.9b04534

وصف الملف: application/pdf

الاتاحة: https://research.tue.nl/en/publications/14530bc6-3d57-44a6-bea7-1949c8b5f5b3
https://doi.org/10.1021/acs.jpcb.9b04534
https://pure.tue.nl/ws/files/132720460/acs.jpcb.9b04534.pdf
http://www.scopus.com/inward/record.url?scp=85070535992&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Lyulin, Alexey V.

المصدر: Sengupta , S & Lyulin , A V 2018 , ' Molecular dynamics simulations of substrate hydrophilicity and confinement effects in capped nafion films ' , Journal of Physical Chemistry B , vol. 122 , no. 22 , pp. 6107-6119 . https://doi.org/10.1021/acs.jpcb.8b03257

وصف الملف: application/pdf

الاتاحة: https://research.tue.nl/en/publications/13b5a6fe-03f6-45ef-b7b2-3f99e73c0033
https://doi.org/10.1021/acs.jpcb.8b03257
https://pure.tue.nl/ws/files/100456358/Manuscript.pdf
https://pure.tue.nl/ws/files/100456361/SUPPLEMENTARY_MATERIAL.pdf
https://pure.tue.nl/ws/files/101306511/acs.jpcb.8b03257.pdf
http://www.scopus.com/inward/record.url?scp=85047077838&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Lyulin, Alexey V., Kritikos, Georgios, Karatasos, Konstantinos, Venkatnathan, Arun, Pant, Rakesh, Komarov, Pavel V.

المساهمون: Ginzburg, Valeriy V., Hall, Lisa M.

المصدر: Sengupta , S , Lyulin , A V , Kritikos , G , Karatasos , K , Venkatnathan , A , Pant , R & Komarov , P V 2020 , Multiscale Modeling Examples : New Polyelectrolyte Nanocomposite Membranes for Perspective Fuel Cells and Flow Batteries . in V V Ginzburg & L M Hall (eds) , Theory and Modeling of Polymer Nanocomposites . Springer Series in Materials Science , vol. 310 , Springer , Cham , pp. 133-177 . https://doi.org/10.1007/978-3-030-60443-1_6

مصطلحات موضوعية: /dk/atira/pure/sustainabledevelopmentgoals/affordable_and_clean_energy, name=SDG 7 - Affordable and Clean Energy

الاتاحة: https://research.tue.nl/en/publications/f25e4681-e136-4422-be05-dcb23324df67
https://doi.org/10.1007/978-3-030-60443-1_6
http://www.scopus.com/inward/record.url?scp=85099519285&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Lyulin, Alexey V., Kritikos, Georgios, Karatasos, Konstantinos, Venkatnathan, Arun, Pant, Rakesh, Komarov, Pavel V., Ginzburg, Valeriy V., Hall, Lisa M.

المساهمون: Multiscale Simulations of Polymer Dynamics, Soft Matter and Biological Physics, ICMS Affiliated, EIRES Chem. for Sustainable Energy Systems, EIRES Systems for Sustainable Heat

المصدر: Theory and Modeling of Polymer Nanocomposites, 133-177
STARTPAGE=133;ENDPAGE=177;TITLE=Theory and Modeling of Polymer Nanocomposites
Theory and Modeling of Polymer Nanocomposites ISBN: 9783030604424

مصطلحات موضوعية: Nanocomposite, Materials science, Nanotechnology, Electrolyte, Multiscale modeling, Energy storage, Polyelectrolyte, chemistry.chemical_compound, Membrane, chemistry, Nafion, Proton transport, SDG 7 - Affordable and Clean Energy, SDG 7 – Betaalbare en schone energie

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8945bde7f76127d243b1adeb9459e65f
https://research.tue.nl/nl/publications/f25e4681-e136-4422-be05-dcb23324df67

المؤلفون: Pant, Rakesh, Sengupta, Soumyadipta, Lyulin, Alexey V., Venkatnathan, Arun

المصدر: Pant , R , Sengupta , S , Lyulin , A V & Venkatnathan , A 2020 , ' Charge delocalization effects on Nafion structure and water /proton dynamics in hydrated environments ' , Fluid Phase Equilibria , vol. 504 , 112340 . https://doi.org/10.1016/j.fluid.2019.112340

مصطلحات موضوعية: Charge delocalization, Cluster distribution, Diffusion coefficient, Molecular dynamics, Nafion

الاتاحة: https://research.tue.nl/en/publications/00f2eb10-b815-4953-990b-8e7ff0afc712
https://doi.org/10.1016/j.fluid.2019.112340
http://www.scopus.com/inward/record.url?scp=85072923189&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Kritikos, Giorgos, Karatasos, Konstantinos, Venkatnathan, Arun, Pant, Rakesh, Komarov, Pavel, Lyulin, Alexey V.

المصدر: AIP Conference Proceedings ; ISSN 0094-243X

الاتاحة: http://dx.doi.org/10.1063/1.5045866
http://aip.scitation.org/doi/pdf/10.1063/1.5045866

المؤلفون: Kritikos, Georgios, Pant, Rakesh, Sengupta, Soumyadipta, Karatasos, Kostas, Venkatnathan, Arun, Lyulin, Alexey V.

المصدر: Kritikos , G , Pant , R , Sengupta , S , Karatasos , K , Venkatnathan , A & Lyulin , A V 2018 , ' Nanostructure and dynamics of humidified nafion/graphene-oxide composites via molecular dynamics simulations ' , Journal of Physical Chemistry C , vol. 122 , no. 40 , pp. 22864-22875 . https://doi.org/10.1021/acs.jpcc.8b07170

Relation: https://research.tue.nl/en/publications/d1d2e195-6c5a-4ab7-b95e-10b81547c50b

الاتاحة: https://research.tue.nl/en/publications/d1d2e195-6c5a-4ab7-b95e-10b81547c50b
https://doi.org/10.1021/acs.jpcc.8b07170
http://www.scopus.com/inward/record.url?scp=85054745192&partnerID=8YFLogxK

المؤلفون: Sengupta, Soumyadipta, Pant, Rakesh, Komarov, Pavel, Venkatnathan, Arun, Lyulin, Alexey V.

المساهمون: SURF

المصدر: International Journal of Hydrogen Energy ; volume 42, issue 44, page 27254-27268 ; ISSN 0360-3199

الاتاحة: http://dx.doi.org/10.1016/j.ijhydene.2017.09.078
https://api.elsevier.com/content/article/PII:S0360319917337096?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0360319917337096?httpAccept=text/plain

المؤلفون: Sengupta, Soumyadipta

المساهمون: King, Michael, Datta-Gupta, Akhil, Pope, Michael

مصطلحات موضوعية: Pore Network, Carbonate, Transient Analysis, Permeability, Dijkstra, Eikonal Equation

وصف الملف: application/pdf

Relation: https://hdl.handle.net/1969.1/156864

الاتاحة: https://hdl.handle.net/1969.1/156864