Faculty Member Profile

Dr. Md. Khorshed Alam
Associate Professor & Chairman
Physics
PhD
+88-017-6336-0975
khorshed_du@yahoo.com, dmkalam@bu.ac.bd

Modeling based on multi-scale simulation is a key methodology to make a breakthrough in the technology meeting a future demand. Our laboratory investigates a fundamental of multi-scale computational Physics/Chemistry and its application to key technologies in industry, for example; design of secondary battery (polymer electrolyte fuel cell, lithium ion battery, and metal air battery), organic solar cells, Tribological properties of head-disk drive interface etc.
Research Interests outline:
➢ Li-air battery
➢ Polymer electrolyte fuel cell
➢ Solar cells
➢ Organic solar cells
➢ Tribology of head-disk drive interface in HDD
➢ Automobile exhausts catalysts

Publications in peer reviewed Journals:

https://scholar.google.co.jp/citations?Khorshed

https://www.researchgate.net/profile/Md_Khorshed_Alam

1. Md. Khorshed Alam, Hiromitsu Takaba, Title, “Structural Analyses of [Li salt+triglyme)] and ionic transport in Li-Air Battery using Molecular Dynamics Simulation”, Bangladesh Journal of Physics, in press, (2020).

2. Md. Khorshed Alam, Md. Saif Ishtiaque, Md. Imran Hossain, Hiromitsu Takaba, Title”,INTERMOLECULAR VIBRATIONAL MODES OF CRYSTALLINE POLY-(R)-3-HYDROXYBUTYRA TE OBSERVED A T TERAHERTZ FREQUENCIES INVESTIGATED BY MOLECULAR DYNAMICS” Bangladesh Journal of Physics, Vol.26, pp.21-31, (2019). https://bdphso.org/

3. M. A. Islam Md. Khorshed Alam, Md. Alauddin, Rahima Nasrin, Md. Imran Hossain, Md. Saif Ishtiaque, “SURFACE STRUCTURE AND REDUCTION PROCESSES OF Ti DOPED CeO2: A ULTRA ACCELERATED QUANTUM CHEMICAL MOLECULAR DYNAMICS STUDY” Barishal University Journal Part1,Vol.5,1&2,pp. 163-178, (2018) https://bu.ac.bd/?ref=BUJ1V5I12.

4. R. Nasrin, S.M.T. Islam and Md. Khorshed Alam “GENERATION AND VALIDATION OF A WIMSD-5B MULTIGROUP CONSTANTS LIBRARY BASED ON JENDL-3.3 NUCLEAR DATA” Barishal University Journal Part 1, Vol. 5, 1&2,pp. 195-201, (2018) https://bu.ac.bd/?ref=BUJ1V5I12.

5. Takatoshi Fujita, Md. Khorshed Alam and Takeo Hoshi, Title,“Thousand-atom ab initio calculations of excited states at organic/organic interfaces: toward first-principles investigations of charge photogeneration” Phys. Chem. Chem. Phys. (PCCP), Vol. 20, 41, pp. 26443-26452, Royal Society of Chemistry, UK, (2018). https://doi.org/10.1039/C8CP05574B IF: 3.567

6. Md. Khorshed Alam and H. Takaba “Equilibrium atomic conformation of Pt2Ru3 nanoparticles under gas atmosphere of CO/H2investigated by density functional theory and Monte Carlo simulation, Material Research Communication, Vol.8, 2,pp.562-569, CAMBRIDGE UNIVERSITY PRESS, UK, (2018) DOI: https://doi.org/10.1557/mrc.2018.44 IF: 1.935.

7. Md. Khorshed Alam, S. Saito and H. Takaba, Title: “Modeling of equilibrium conformation of Pt2Ru3 nanoparticles using the density functional theory and Monte Carlo simulation and CO Adsorption on the Pt2Ru3 Surface, Journal of Material Research, Vol. 32(8) pp.1573-1581, 2017, CAMBRIDGE UNIVERSITY PRESS, UK DOI: https://doi.org/10.1557/jmr.2017.57 IF: 1.982

8. Takaba, Hiromitsu; Shou, Kimura; Md. Khorshed Alam Title: “Crystal and electronic structures of substituted halide perovskites based on density functional calculations and molecular dynamics” Chemical Physics, Vol. 485-486pp.22-28,2017. https://doi.org/10.1016/j.chemphys.2016.12.007. IF:1.882

9. H. Takaba, T. Hisabe, T. Shimizu and Md. Khorshed Alam, Title: “Molecular modeling of OH-transport in poly(arylene ether sulfone ketone)s containing quaternizedammonio-substituted fluorenyl groups as anion exchange membranes”, Journal of Membrane Science, 522, 237-244 (2017). Elsevier, Netherlands, (https://doi.org/10.1016/j.memsci.2016.09.019. IF: 7.015

10. Md. Khorshed Alam, S. Saito and H. Takaba, Title: “Density Functional Theory Study on the adsorption of H, OH, and CO and coadsorption of CO with H/OH on the Pt2Ru3 surfaces” Journal of Material Research, 31, pp. 2617-2626 (2016) CAMBRIDGE UNIVERSITY PRESS, UK (https://doi.org/10.1557/jmr.2016.286) IF: 1.6.

11. T. H. Chowdhury, A. Islam, A.K. M. Hasan, M. Arunakumari, S.P. Singh, Md. Khorshed Alam, I. M. Bedja, Md. H. Ruslan, K. Sopian, N. Amin, and Md. Akhtaruzzaman, Title: ‘‘Prospects of Graphene as a Potential Carrier Transport Material in Third Generation Solar Cells” Chemical Record. Vol.16 pp-614-632, 2016. Wiley, Japan. (http://www.ncbi.nlm.nih.gov/pubmed/26816190) IF: 5.771.

12. Md. Khorshed Alam and H. Takaba, Title: ‘‘Density Functional Theory Study of OH and CO Adsorption on the Pt2Ru3 Surface ”ECS Transaction, Vol. 64 (3): 689-695, 2014, ECS, USA. (http://ecst.ecsdl.org/content/64/3/689.abstract) IF: 0.47

13. Md. Khorshed Alam and HiromitsuTakaba, Title: ‘‘Stability of Pt-Ru Alloy for Anode Catalyst in PEFC Fuel Cell: A Density Functional Theory Study” ECS Transactions, Vol. 61(13): 1-6, 2014, ECS, USA. (http://ecst.ecsdl.org/content/61/13/1.abstract) IF:0.47

14. W. Yamamoto, Md. Khorshed Alam and H. Takaba, Title: ‘‘Dynamics of Deposited Li2O2 on Cathode Surface in Li-O2 Battery by First-Principles Calculation” ECS Transactions, Vol. 61 (13): 55-61, 2014, ECS, USA. (http://ecst.ecsdl.org/content/61/13/63.abstract) IF: 0.47

15. H. Takaba, N. Shimizu, T. Hisabe and Md. Khorshed Alam, Title: ‘‘Modeling of transport mechanisms of OH- in electrolyte of alkaline fuel cell” ECS Transaction, Vol. 61(13): 63-69, 2014. ECS, USA. (http://ecst.ecsdl.org/content/61/13/63.abstract) IF: 0.47

16. Md. Khorshed Alam, H. Zhang, N. Koga and S. Iuchi, Title: ‘‘Ultraviolet bonding of perfluoropolyethers to carbon surfaces investigated using quantum chemical methods” Journal of Microsystems Technologies, Vol.19 No.9-10, pp. 1383-1391, 2013, Springer, Germany. http://link.springer.com/article/10.1007/s00542-013-1824-x IF: 1.515.

17. Md. Khorshed Alam, F. Ahmed, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, M. Kubo and A. Miyamoto, Title: ‘‘Surface reduction processes of cerium oxide surfaces by H2 using ultra accelerated quantum chemical molecular dynamic study” Catal. Today, Vol.164, pp.9–15, 2011, Elsevier, Netherlands. http://www.sciencedirect.com/science/article/pii/S0920586110006127 IF: 4.95.

18. F. Ahmed, Md. Khorshed Alam, R. Miura,A. Suzuki, H.Tsuboi, N. Hatakeyama,A. Endou,H. Takaba, M. Kubo and A. Miyamoto, Title: ‘‘Modeling of hydrogen vacancy for dissociative adsorption of H2 on Pd (1 11) surface by a quantum chemical molecular dynamics” Catal. Today, Vol. 164, pp. 16-22,2011, Elsevier, Netherlands. http://loop.frontiersin.org/publications/28415746 IF: 4.95.

19. Md. Khorshed Alam, F. Ahmed, R. Miura, A. Suzuki, H.Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, M. Kubo and A. Miyamoto, Title: ‘‘Study of reduction processes over cerium oxide surfaces with atomic hydrogen using ultra accelerated quantum chemical molecular dynamics” Appl. Surf. Sci., Vol.257, pp. 1383-1389, 2010, Elsevier, Netherlands. http://www.sciencedirect.com/science/article/pii/S0169433210010925 IF: 5.270.

20. F. Ahmed, Md. Khorshed Alam, R. Miura,A. Suzuki, H.Tsuboi, N. Hatakeyama,A. Endou,H. Takaba, M. Kubo and A. Miyamoto, Title: ‘‘Adsorption and dissociation of molecular hydrogen on Pt/CeO2 catalyst in the hydrogen spillover process: A quantum chemical molecular dynamics study” Appl. Surf. Sci. Vol. 256, pp. 7643-7652, 2010, Elsevier, Netherlands. http://www.sciencedirect.com/science/article/pii/S0169433210008408. IF 5.270.

21. Md. Khorshed Alam, F. Ahmed, K. Nakamura, A. Suzuki, R. Sahnoun, H. Tsuboi, M. Koyama, N. Hatakeyama, A. Endou, H. Takaba, C. A. Del Carpio, M. Kubo and A. Miyamoto, Title: ‘‘Study of Carbon Monoxide Oxidation on CeO2(111) Using Ultra Accelerated Quantum Chemical Molecular Dynamics” J. Phys. Chem. C, Vol. 113, pp. 7723-7727, 2009, ACS, USA. (http://pubs.acs.org/doi/pdf/10.1021/jp8088963) IF: 4.509.

22. F. Ahmed, Md. Khorshed Alam, A. Suzuki, R. Sahnoun, H.Tsuboi, M. Koyama, N. Hatakeyama, A. Endou,H. Takaba, C. A. Del Carpio,M. Kubo and A. Miyamoto, Title: ‘‘Dynamics of Hydrogen Spillover on Pt/γ-Al2O3 Catalyst Surface: A Quantum Chemical Molecular Dynamics Study” J. Phys. Chem. C, Vol. 113, pp. 15676-15683, 2009, ACS, USA. (http://pubs.acs.org/doi/abs/10.1021/jp903606e) IF: 4.509.

Published proceedings articles:

23. Md. Khorshed Alam, and H. Takaba “Title: CO tolerance mechanism on Pt2Ru3 anode catalysts” Proceedings of 7th International fuel cell workshop, pp: 41 August, 2015.

24.Md. Khorshed Alam, et al., “Title: Dynamical characteristics of Ti doped ceria surface and its catalytic activity” Proceedings on catalysis society of Japan Vol. 108. pp: 530, Sept. 2011. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201102224124011022&q=%22200901100439660140%22&t=0

25. Md. Khorshed Alam, et al., “Title: Analysis of Electronic Structure for Nondoped and Ti Doped Ceria Surface: A Quantum Chemical Molecular Dynamics Study” Proceedings on catalysis society of Japan Vol. 107. pp: 114, March 2011. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201102209378811674&q=%22200901100439660140%22&t=0

26. Md. Khorshed Alam, et al., “Title: Doping of ceria surface with Ti and its catalytic activity: a Quantum Chemical Molecular Dynamics Study” Proceedings of the Japan Association of Computer Chemistry Annual Meeting, Spring pp: 111, June 2011. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201102266922649979&q=%22200901100439660140%22&t=0

27. Md. Khorshed Alam, et al., “Title: Ultra-accelerated Quantum Chemical Molecular Dynamics Study of Sintering Dynamics of Pt/CeO2” Proceedings on 7th International Conference on Flow Dynamics pp:684-685, Nov. 2010.

28. F. Ahmed, Md. Khorshed Alam, “Title: Ultra-accelerated Quantum Chemical Molecular Dynamics Study of to Investigate CO Oxidation and NO Reduction on MgO (100) Supported Pd Cluster.” Proceedings on 7th International Conference on Flow Dyna-mics pp: 662-663, Nov. 2010.

29. Md. Khorshed Alam, et al., “Title: Sintering Inhibition Mechanisms of Pt on Ceria Surface Using Ultra Accelerated Quantum Chemical Molecular Dynamics Study” Proceedings on catalysis society of Japan Vol. 52. pp: 411-413, Sept. 2010. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002269069454390&q=%22200901100347227822%22&t=0

30. Md. Khorshed Alam, et al., “Title: Ultra-accelerated quantum chemical molecular dynamics study and sintering dynamics of metal /CeO2 interface” Proceedings on catalysis society of Japan Vol. 105. pp: 71, March 2010. http//jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002269035520963&q=%22200901100439660140%22&t=0

31. F. Ahmed, Md. Khorshed Alam, “Title: Dissociative Adsorption of Hydrogen on Pd and Influence of the Surface Hydrogen Vacancy: A Quantum Chemical Molecular Dynamics Study” Proceedings of the Japan Association of Computer Chemistry Annual Meeting: Spring, pp: 79, Spring, 2010. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002201969679300&q=%22200901100439660140%22&t=0

32. Md. Khorshed Alam et al., “Title: Ultra-accelerated quantum chemical molecular dyna-mics study of surface reduction process of CeO2(111) and 110) by H2” Proceedings on Sixth international conference on flow dynamics pp:330-331, Nov. 2009. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002260481531823&q=%22200901100347227822%22&t=0

33. F. Ahmed, and Md. Khorshed Alam, “Title: Influence of the Surface Hydrogen Vacancy for the Dissociative Adsorption of H2 on Pd(111) Surface: A Quantum Chemical Molecular Dynamics Study Proceedings on Sixth international conference on flow dynamics” pp:328-329, Nov.2009.

34. F. Ahmed, Md. Khorshed Alam, et al. “Title: QCMD study to investigate the influence of the hydrogen vacancy for the dissociative adsorption of hydrogen on Pd (111) surface” Japan Computer Society Annual Lecture Proceedings Issue: Autumn pp: 50, Nov. 2009. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002220270855957&q=%22200901100496125790%22&t=0

35. Md. Khorshed Alam, et al. “Title: Quantum Chemical Study of Surface Reduction Mechanism of CeO2(111) by H2” Japan Computer Society Annual Lecture Proceedings Issue: Spring pp: 62-63, 2009. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002202644641460&q=%22200901100439660140%22&t=0

36. Md. Khorshed Alam, et al. “Title: Ultra-accelerated quantum chemical molecular dynamics study of the dynamics of Pt/CeO2 interface” Proceedings on catalysis society of Japan Vol. 104. pp: 509, Sept. 2009. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002200745915940&q=%22200901100439660140%22&t=0

37. Md. Khorshed Alam, et al., “Title: Ultra-accelerated quantum chemical molecular dynamics study of surface reduction process of CeO2(111) and CeO2(110) by H2” Proceedings of the Japan Association of Computer Chemistry Annual Meeting: Autumn pp: 59, Nov. 2009. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=201002260481531823&q=%22200901100439660140%22&t=0

38. Md. Khorshed Alam, et al. “Title: Study of Surface Reduction Mechanisms over CeO2 (111) using Ultra Accelerated Quantum Chemical Molecular Dynamics” Proceedings of the Japan Association of Computer Chemistry Annual Meeting, Spring, pp-57, 2008 http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=200902252825953206&q=%22200901100347227822%22&t=0

39. Md. Khorshed Alam, et al. “Title: Quantum Chemical Molecular Dynamics Study of Surface Reduction Mechanisms of CeO2 by atomic hydrogen” Proceedings on catalysis society of Japan Vol. 102. pp: 418, Sept. 2008. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=200902218871430168&q=%22200901100439660140%22&t=0

40.Md. Khorshed Alam, et al. “Title: Study of Carbon Monoxide Oxidation over CeO2 using ultra accelerated quantum chemical molecular dynamics” Chemical Engineering Society full meeting Proceedings. Vol: 40 pp: T121, Aug. 2008. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=200902252825953206&q=%22200901100439660140%22&t=0

41. Md. Khorshed Alam, et al. “Title: Ultra-accelerated quantum chemical molecular dynamics study of Metal Oxides for Catalyst Support” Proceedings on catalysis society of Japan Vol. 101. pp: 52, March 2008. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=200902242609014267&q=%22200901100347227822%22&t=0

42. Md. Khorshed Alam, et al. “Title: Surface Reduction Mechanisms over CeO2 Surface using Ultra Acceleration Quantum Chemical Molecular Dynamics, Seminar Symposium, Vol. 103rd, pp-62. http://jglobal.jst.go.jp/en/detail?JGLOBAL_ID=200902261164882365&q=%22200901100347227822%22&t=0


Personal website: www.khorshed.net


Administrative Experiences:

  • Director TSC, University of Barishal: (1st July, 2018 to till date).

Teaching/Research Experiences:

  • Assistant Professor: (1st January, 2018 to till date) 
  • Postdoctoral Researcher:
    Institute for Molecular Science (IMS), Japan. (Feb. 2017-Jan. 2018)  
  • Assistant Professor:
    Daffodil International University, Dhaka, Bangladesh. (Fall semester, 2016).   
  • Postdoctoral Researcher:
    Faculty of Engineering, Kogakuin University, Tokyo, Japan. (Oct. 2013 to Sept. 2016).  
  • Postdoctoral Researcher:
    Graduate School of information science, Nagoya University, Japan. (Oct. 2011 to Sept. 2013). 
  • PhD Student:
    Graduate School of Engineering, Tohoku University, Japan. (Oct. 2008 to Sept. 2011).
  • Research Assistant: Graduate School of Science. Tohoku University (Oct. 2008 to Sept. 2011).
  • Research Student:
    Graduate School of Engineering, Tohoku University, Japan. (Oct. 2007 to Sept. 2008).
  • Lecturer:
    Lalbagh Model School & College, Dhaka, Bangladesh. (July. 2007 to Oct. 2007).   
  • Assistant Teacher:
    Meherpur Govt. Girls` School, Meherpur, Bangladesh. (December. 2006 to July. 2006).
  • Assistant Teacher:
    Udyan School & College, Dhaka, Bangladesh. (December. 2006 to July. 2006).
  • Writter & Editor:
    Panjeree Publications Ltd. Dhaka, Bangladesh. (Dec. 2005 to July. 2006).

Reviewer:  

  • Journal of Heliyon (Elsevier Publishers, Netherlands).
  • The Electrochemical Society (ECS Journal, USA).
  • Bangladesh Journal of Physics (Physical Society, Bangladesh).

Member of Professional Society:

  • American Chemical Society (ACS), USA.  
  • Catalysis Society of Japan, Japan.  
  • American Society of Machanical Engineers (ASME), USA.
  • Bangladesh Physical Society (BPS), Bangladesh.
  • Japan Applied Physics Society, Japan.
  • Local Convenor of bdSTEM Society, Bangladesh.

Academic  Conferences:

1. Md. Khorshed Alam, Md. S. Ishtiaque, Md. I. Hossain and T. Fujita, Title “Charge Transfer Excited-State Calculation for large size C60/Pentacene interface Based on the Fragment Molecular Orbital Method” 05-07 March, 2020; Atomic Energy Centre, Dhaka, Bangladesh, 2020.

2. Md. Khorshed Alam, Takatoshi Fujita, Title “Charge transfer excited-states calculation for C60/Pentacene interface based on the fragment molecular orbital method” National Conference on Electronics and Informatics, 04-05 December, Atomic Energy Centre, Dhaka, Bangladesh, 2019.

3. Md. Khorshed Alam et al. Title “Excited states calculations for C60/Pentacene Interface” IFAEE Conference, 1, November, Tokyo, Japan, 2018.

4. Md. Ariful Ul Islam, T.S. Joytu, T. Rahman, Md. Khorshed Alam, Title Investigation of Structural and magnetic properties of nanocrystalline LiMnNi ferrites sintered at various sintering temperature, IFAEE conference, 1 November, Tokyo, Japan, 2018.

5. Md. Khorshed Alam, T. Fujita, Title “Energy and Charge transfer excitation at Donor/Acceptor interface using Fragment Molecular Orbital Method” Professional development Consortium for Computational Material Scientists (PCoMS) 9-10 Nov. Tohoku University, Japan, 2017.

6.Md. Khorshed Alam, T. Fujita, Title “Excited-State Calculation for large size C60/Pentacene interface Based on the Fragment Molecular Orbital Method” Japan Society of Applied Physics (JSAP), 5-8 Sept. Fukuoka, Japan, 2017.

7.Md. Khorshed Alam et al. Title “Stability of Pt-Ru alloy for anode catalyst and CO tolerance mechanism in PEFC using combined DFT and Monte Carlo Simulation”18th International Workshop on Computational Physics and Materials Science: Total Energy and Force Methods” organized by International Centre for Theoretical Physics (ICTP), 12-14 Jan. Trieste, Italy 2017.

8.Md. Khorshed Alam, S. Kimura, and H. Takaba “Title: Crystal structure and electronic status of substituted halide perovskite based on density functional calculation and Molecular Dynamics” Joint seminar on Material Science, 19th July, Tokyo Institute of Technology, Tokyo, Japan, 2016.

9.S. Saito, Md. Khorshed Alam, H. Takaba, Title: “Stability of Pt2Ru3anode catalysts against CO in fuel cell by the novel material informatics method” Materials Research Society (MRS) Fall Meeting, Nov. 29-Dec.4, Boston, USA, 2015.

10.Md. Khorshed Alam and H. Takaba, Title: “Stability of Pt-Ru alloy for anode catalyst and CO tolerance mechanism in PEFC Fuel Cell using multi-scale modeling approach” 17th Tropical Meeting ISE, Saint-Malo, 31 May-3 June, France, 2015.

11.Md. Khorshed Alam and H. Takaba, Title: “Stability of Pt2Ru3 anode catalysts against CO in PEFC using multiscale modeling” World Engineering Conference and Convention, 29 Nov- 2 Dec. Kyoto, 2015.

12.Md. Khorshed Alam and H. Takaba, Title: “CO tolerance mechanism on Pt2Ru3 anode catalysts” 7thInternational Fuel Cell workshop, 27-28 August, Yamanashi University, Japan, 2015.

13. Md. Khorshed Alam and H. Takaba, Title: “DFT Study of OH and CO Adsorption on the Pt2Ru3 surface” 21st International SPACC Symposium, Oct.31-Nov.3, Kogakuin University, Japan, 2015.

14.W. Yamamoto, H. Takaba, and Md. Khorshed Alam, Title: “First Principles Calculations of Discharge Precipitates in Li-air Battery Cathode” 21st International SPACC Symposium, Oct.31-Nov.3, Kogakuin University, Japan, 2015.

15.Md. Khorshed Alam and H. Takaba, Title: “Modeling of Degradation of Pt-Ru Alloy Catalyst by CO using Atomistic Scale Simulations” 226th ECS Meeting, October 5-9, Caucun, Mexico, 2014.

16.Md. Khorshed Alam and H. Takaba, Title: “Stability of Pt-Ru Alloy for Anode Catalyst in PEFC Fuel Cell: A Density Functional Theory Study” 225th ECS Meeting, Orlando, Florida, USA, May 11-14, 2014.

17.W. Yamamoto, H. Takaba, and Md. Khorshed Alam, Title: “Dynamics of Deposited Li2O2 Clusters on Cathode Surface in Li-air Battery Investigated by First-Principles Molecular Dynamics” 225th ECS Meeting, Orlando, Florida, USA, May 11-14, 2014.

18.Md. Khorshed Alam and H. Takaba, Title: “Stability and Degradation of Pt-Ru alloy for Anode Catalyst Against CO in PEFC Fuel Cell using Multi-Scale Simulation” TOCAT7, Kyoto, Japan, June 1-6, 2014.

19.Md. Khorshed Alam and H. Zhang, Title: “Quantum Chemical Study of Interactions of Perfluoropolyether with Carbon Surfaces: Effects of Nitrogen Incorporation and Ultraviolet Irradiation”12th Joint MMM/Inter-mag Conference Chicago, USA, January 14-18, 2013.

20.Md. Khorshed Alam and H. Zhang, Title: “Ultraviolet bonding of Perfluoropolyetherether to carbon surfaces investigated using quantum chemical method”2012 ASME-ISPS /JSME-IIP Joint International Conference on Micromechatronics for Information and Precision Equipment (MIPE2012, Santa Clara, California, USA, June 18-20, 2012.

21.H. Zhang, Y. Kawai, M. Fukuda, Md. Khorshed Alam, K. Fukuzawa, S. Itoh, Title: “Molecular Dynamics Simulations of UV Patterning of Nanometer-thick Liquid Lubricant Films”2012 ASME-ISPS /JSME-IIP Joint International Conference on Micromechatronics for Information and Precision Equipment (MIPE2012, June 18-20, Santa Clara, California, USA, 2012.

22.Md. Khorshed Alam and H. Zhang, Title: “Quantum Chemical Study of Ultraviolet Bonding of Perfluoropolyethers to Graphene” JST International Symposium on Multi-scale Simulation of Condensed phase Reacting System, May 10-12, Nagoya, Japan, 2012.

23.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Doping of ceria surface with Ti and its catalytic activity: a Quantum Chemical Molecular Dynamics Study” The Meeting of Computational Chemistry, June 15-17, Tokyo, Japan, 2011.

24.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Dynamical characteristics of Ti doped ceria surface and its catalytic activity” 108th Catalysis society of Japan, Sept. 20-21, Hokkaido, Japan, 2011.

25.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Analysis of Electronic Structure for Nondoped and Ti Doped Ceria Surface: A Quantum Chemical Molecular Dynamics Study” 107th Catalysis society of Japan, March 18-20, Tokyo, Japan, 2011.

26.Md. Khorshed Alam, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Sintering Inhibition Mechanisms of Pt on Ceria Surface Using Ultra Accelerated Quantum Chemical Molecular Dynamics Study” 106th Catalysis society of Japan, Sept. 15-18, Yamanashi, Japan, 2010.

27.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Ultra-accelerated quantum chemical molecular dynamics study of surface reduction processes of CeO2(111) and CeO2(110) by H2” Six Tokyo Conference on Advanced Catalytic Science and Technology, Supporo, Japan, July 18-23, 2010.

28.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Ultra-accelerated quantum chemical molecular dynamics study of sintering dynamics of Pt/CeO2 interface” 13thInterna-tional Conference on Theoretical Aspects of Catalysis, Matshushima, Japan, June 21-25, 2010.

29.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Ultra-accelerated quantum chemical molecular dynamics study and sintering dynamics of metal/CeO2 interface” 105th Catalysis society of Japan, March 24-25, Kyoto, Japan, 2010.

30.Md. Khorshed Alam, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Surface reduction mechanism of ceria surfaces by H2 using ultra accelerated quantum chemical molecular dynamics” Surface Science Society of Japan, March 10-11, Tohoku University, Japan, 2010.

31.Md. Khorshed Alam, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Ultra accelerated quantum chemical molecular dynamics study of the Pt/CeO2 interface” 104th catalysis society of Japan, Sept. 27-30, Miyazaki University, Japan, 2009.

32.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Ultra accelerated Quantum Chemical Study of Surface Reduction mechanisms of CeO2(111) by H2” The Meeting of Computational Chemistry, Tokyo, Japan, May 21-22, 2009.

33.Md. Khorshed Alam, A. Suzuki, R. Sahnoun, M. Koyama, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, C.A. Del. Carpio, M. Kubo, A. Miyamoto Title: “Quantum Chemical Molecular Dynamics Study of Surface Reduction Mechanisms of CeO2 by atomic hydrogen” 102nd Catalysis society of Japan, Nagoya, Japan, Sept. 23-26, 2008.

34.Md. Khorshed Alam, A. Suzuki, R. Sahnoun, M. Koyama, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, C.A. Del. Carpio, M. Kubo, A. Miyamoto Title: “Study of Carbon Monoxide Oxidation over CeO2(111) using Ultra accelerated quantum chemical molecular dynamics” 40th Autumn Meeting of the Society of the Chemical Engineer, Tohoku University, Japan, Sept. 24-26, 2009.

35.Md. Khorshed Alam, R. Nagumo, R. Miura, A. Suzuki, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, A. Miyamoto, Title: “Study of Surface Reaction Mechanisms over CeO2 (111) using Ultra Accelerated Quantum Chemical Molecular Dynamics” ICC 14th Pre-symposium, Kyoto, Japan, July 9-11, 2008.

36.Md. Khorshed Alam, A. Suzuki, R. Sahnoun, M. Koyama, H. Tsuboi, N. Hatakeyama, A. Endou, H. Takaba, C.A. Del. Carpio, M. Kubo, A. Miyamoto, Title: “Ultra-Accelerated Quantum Chemical Molecular Dynamics Study on Metal Oxides for Catalyst Support” 101stCatalysis society of Japan, March 28-29,Tokyo, Japan, 2008.