National Institute Of Technology,Kurukshetra

DEPARTMENT OF CHEMISTRY

Faculty

Name : Ghule Vikas Dasharath
Designation : Assistant Professor
Qualification : M.Sc, Ph.D.
Current Address :

House No. CB-3, NIT-Campus, NIT-Kurukshetra, Kurukshetra-136119, Haryana


Phone 1 (office) : 9896006804
Phone 2 (office) :
Email : gvd@nitkkr.ac.in, ghule.vikas@gmail.com , ghule.vikas@rediffmail.com

Area Of Intrest :

  •  High Energy Materials: Computational design and Synthesis 
  • Conducting polymers: Synthesis, modeling and applications.
  • Synthesis of nitrogen-rich materials 
  • Anion sensors

Experience :

  •  4 Years

Other :

Research Publications -      Total number of Publications = 40

  1. M. Hanumantha Rao, V. D. Ghule and K. Muralidharan, N2,N2,N4,N4,N6,N6-hexa(1Htetrazol-5-yl)-1,3,5-triazine-2,4,6-triamine as a nitrogen-rich material, Journal of Chemical Sciences, 2017, (Accepted).
  2. Papiya Parbat, Alka Devi, and V. D. Ghule, Computational Assessment of Nitrogen-rich Peracids: a Family of Peroxide Based Energetic Materials, RSC Adv. 2017, 7, 2158521591.
  3. Nagarjuna Kommu, M. Balaraju, V. D. Ghule and Akhila K. Sahoo, Synthetic manifestation of nitro substituted tetrazole-N-(hetero)aryl derivatives and energetic studies, J. Mater. Chem. A, 2017, 5, 7366–7371.
  4. Alka Devi, V. D. Ghule, Hydroxide Derivatives of Tetrazole: Computational Design Approach for High Energy Materials, Canadian Journal of Chemistry, 2016, 94, 738-743.
  5. N. Yedukondalu, V. D. Ghule and G. Vaitheeswaran, High pressure structural, elastic and vibrational properties of green energetic oxidizer ammonium dinitramide, J. Chem. Phys. 2016, 145, 064706.
  6. V. D. Ghule, Sonal Deswal, Alka Devi, Tittal Ram Kumar, Computer-Aided Design of Energetic Tris(tetrazolyl)amine Derivatives and Salts, Ind. Eng. Chem. Res., 2016, 55, 875–881.
  7. D. Srinivas, V. D. Ghule, Synthesis of nitrate ester and nitramine derivatives of poly?uoro alkyl compounds for high energy materials, RSC Adv., 2016, 6, 7712.
  8. Alka Devi, Sonal Deswal, Srinivas Dharavath, V. D. Ghule, Molecular design and screening of energetic nitramine derivatives, J. Mol. Model. 2015, 21, 29
  9. Nagarjuna Kommu, A. Sudheer Kumar, J. Raveendra, V. D. Ghule, Akhila K. Sahoo, Synthesis, Characterization and Energetic Studies of Polynitro Aryl-1,2,3-2H-Triazoles, Asian J. Org. Chem. 2016, 5, 138-146.
  10. P. M. Jadhav, S. Radhakrishnan, V. D. Ghule, R. K. Pandey, Energetic salts from nitroformate ion, J. Mol. Model. 2015, 21, 134.
  11. Sonal Deswal, V. D. Ghule, Tittal Ram Kumar, S. Radhakrishnan, Quantum-chemical design of tetrazolo[1,5-b][1,2,4,5]tetrazine based nitrogen-rich energetic materials, Computational and Theoretical Chemistry 2015, 1054, 55–62.
  12. D. Srinivas, V. D. Ghule, K. Muralidharan, Energetic salts from phenolate derivatives, New J. Chem., 2014, 38, 3699.
  13. S. Radhakrishnan, V. D. Ghule, A. K. Sikder, Computational screening of oxetane monomers for novel hydroxy terminated polyethers, J. Mol. Model. 2014, 20, 2253.
  14. A. Sudheer Kumar, K. Nagarjuna, V. D. Ghule, A. K. Sahoo, Synthesis of trifluoromethyl-substituted N-aryl poly-1,2,3-triazole derivatives, J. Mater. Chem. A, 2014, 2, 7917.
  15. D. Srinivas, V. D. Ghule, K. Muralidharan, Synthesis of nitrogen-rich imidazole, 1,2,4-triazole and tetrazole-based compounds, RSC Advances 4, 2014, 7041-7051.
  16. K. Nagarjuna, V. D. Ghule, A. Sudheer Kumar, A. K. Sahoo, Triazole substituted nitroarene derivatives: synthesis, characterization and energetic studies, Chem. Asian J. 9, 2014, 166-178.
  17. V. D. Ghule, Computational screening of nitrogen-rich energetic salts based on substituted triazine, J. Phys. Chem. C 117, 2013, 16840-16849.
  18. V. D. Ghule, D. Srinivas, K. Muralidharan, Energetic monoanionic salts of 3,5-dinitropyridin-2-ol, Asian J. Org. Chem. 2, 2013, 662-668.
  19. N. Yedukondalu, V. D. Ghule and G. Vaitheeswaran, Pressure induced structural phase transition in solid oxidizer KClO3: A first-principles study, J. Chem. Phys. 138, 2013, 174701.
  20. P. M. Jadhav, S. Radhakrishnan, V. D. Ghule, P. Hima, and R. K. Pandey, Quantum-chemical studies on thermodynamic feasibility of MTNI processes, J. Mol. Model. 19, 2013, 3027-3033.
  21. D. Srinivas, V. D. Ghule, K. Muralidharan, H. Donald B. Jenkins, Tetraanionic nitrogen-rich tetrazole based energetic salts, Chem. Asian J. 8, 2013, 1023-1028.
  22. A. Sudheer Kumar, V. D. Ghule, S. Subramanyam, Akhila K. Sahoo, Synthesis of thermally stable energetic 1,2,3-triazole derivatives, Chem Eur. J. 19, 2013, 509-518.
  23. V. D. Ghule, Studies on energetic properties for nitrotetrazole substituted triazole and oxadiazole derivatives with density functional theory, Mol. Phys. 111, 2013, 95-100.
  24. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Quantum chemical studies on energetic azo bridged azoles. J. Energ. Mater. 31, 2013, 35-48.
  25. V. D. Ghule, Computational studies on energetic properties of trinitro substituted imidazole-triazole and pyrazole-triazole derivatives, J. Phys. Chem. A 116, 2012, 9391-9397.
  26. D. Srinivas, V. D. Ghule, S. P. Tewari, and K. Muralidharan, Synthesis of amino, azido, nitro and nitrogen-rich azole substituted derivatives of 1H-benzotriazole for high energy materials applications, Chem Eur. J. 18, 2012, 15031-15037.
  27. N. Yedukondalu, V. D. Ghule and G. Vaitheeswaran, Computational study of structural, electronic, and optical properties of crystalline NH4N3, J. Phys. Chem. C 116, 2012, 16910-16917.
  28. V. D. Ghule, Computational studies on the triazole-based high energy materials, Computational and Theoretical Chemistry, 992, 2012, 92-96.
  29. V. D. Ghule, D. Srinivas, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Computational study on energetic properties of nitro derivatives of furan substituted azoles, Struct. Chem. 23, 2012, 749-754.
  30. V. D. Ghule, D. Srinivas, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Molecular design of amino-polynitroazole based high energy materials, J. Mol. Model. 18, 2012, 3013-3020.
  31. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Computational study on substituted s-triazine derivatives, E-J Chem. 9, 2012, 583-592.
  32. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Quantum-chemical investigation of substituted s-tetrazine derivatives as high energy materials, Bull. Korean Chem. Soc. 33, 2012, 564-570.
  33. V. D. Ghule, P. M. Jadhav, S. Radhakrishnan and R. K. Pandey, Computational design and structure-property relationship studies on heptazines. J. Mol. Model. 17, 2011, 2927-2937.
  34. V. D. Ghule, S. Radhakrishnan and P. M. Jadhav, Computational studies on tetrazole derivatives as potential high energy materials. Struct. Chem. 22, 2011, 775-782.
  35. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Theoretical studies on nitrogen-rich energetic azoles. J. Mol. Model. 17, 2011, 1507-1515.
  36. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and S. P. Tewari, Theoretical studies on polynitrobicyclo[1.1.1]pentanes in search of novel high energy density materials. Chemical Papers, 65, 2011, 380-388.
  37. R. S. Patil, S. Radhakrishnan, P. M. Jadhav, V. D. Ghule and T. Soman, Quantum-chemical studies on TATB processes. J. Energ. Mater. 28, 2010, 98-113.
  38. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav and T. Soman, Molecular dynamics simulations on polythiophenes for chemical sensing applications. Molecular Simulation 36, 2010, 63-68.
  39. V. D. Ghule, S. Radhakrishnan, P. M. Jadhav, R. S. Patil and S. P. Tewari, Electronic structure calculations and structure-property relationships on aromatic nitro compounds. Adv. Sci. Lett. 4, 2010, 136-141.
  40. V. D. Ghule, P. M. Jadhav, R. S. Patil, S. Radhakrishnan and T. Soman, Quantum-chemical studies on hexaazaisowurtzitanes. J. Phys. Chem. A 114, 2010, 498-503.

  Ph.D Supervised - (03 - On going )

Note: Ph. D. position is available for a highly motivated UGC-CSIR NET JRF or GATE qualified candidates.

Sponsored R &D Projects - 

  • Title: Quantum-chemical design, synthesis and energetic properties study of tetrazole based high energy materials
  • Agency: Science &Engineering Research Board (SERB), Department of Science &Technology, Government of India.