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Esha V. Shah - Publications

Affiliations: 
2013-2018 S. V. National Institute of Technology, Surat 
Area:
Chemical physics, nanomaterials
Website:
https://sites.google.com/site/resumeesha/
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12 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2018 Shah EV, Kumar V, Sharma BK, Rajput K, Chaudhary VP, Roy DR. Co-Tetraphenylporphyrin (co-TPP) in TM-TPP (TM = Fe, Co, Ni, Cu, and Zn) series: a new optical material under DFT. Journal of Molecular Modeling. 24: 239. PMID 30120570 DOI: 10.1007/s00894-018-3783-8  0.65
2018 Shah EV, Roy DR. Magnetic switching in Cr (x = 2–8) and its oxide cluster series Journal of Magnetism and Magnetic Materials. 451: 32-37. DOI: 10.1016/J.Jmmm.2017.10.084  0.62
2018 Shah EV, Roy DR. Density functional investigation on hexagonal nanosheets and bulk thallium nitrides for possible thermoelectric applications Applied Nanoscience. 9: 33-42. DOI: 10.1007/S13204-018-0884-8  0.669
2017 Shah EV, Patel CM, Roy DR. Structure, electronic, optical and thermodynamic behavior on the polymerization of PMMA: A DFT investigation. Computational Biology and Chemistry. PMID 29276009 DOI: 10.1016/J.Compbiolchem.2017.10.013  0.66
2017 Roy DR, Shah EV, Mondal Roy S. Optical activity of Co-porphyrin in the light of IR and Raman spectroscopy: A critical DFT investigation. Spectrochimica Acta. Part a, Molecular and Biomolecular Spectroscopy. 190: 121-128. PMID 28922637 DOI: 10.1016/J.Saa.2017.08.069  0.692
2017 Shah EV, Roy DR. Hexagonal thallium nitride in (TlX) 2n+1 H 2n+4 [X = N, P, As; n  = 1–5] cluster series: A promising building motif for future smart nanomaterials Materials Chemistry and Physics. 200: 368-375. DOI: 10.1016/J.Matchemphys.2017.07.090  0.636
2016 Kumar V, Shah EV, Roy DR. Electronic properties of hexagonal gallium phosphide: A DFT investigation Aip Conference Proceedings. 1731. DOI: 10.1063/1.4948098  0.615
2016 Shah EV, Kumar V, Roy DR. DFT investigation on structure, electronic and magnetic properties of Crn (n=2-8) clusters Aip Conference Proceedings. 1728. DOI: 10.1063/1.4946656  0.347
2016 Shah EV, Roy DR. Sc 3 N and Sc 2 C 2 encapsulated B 40 : Smarter than its carbon analogue Physica E: Low-Dimensional Systems and Nanostructures. 84: 354-360. DOI: 10.1016/J.Physe.2016.08.002  0.618
2015 Shah EV, Roy DR. Structure, electronic properties, aromaticity and dynamics of M3N@C80 and M2C2@C82 (M=Sc, Y): A density functional study Physica E: Low-Dimensional Systems and Nanostructures. 70: 157-164. DOI: 10.1016/J.Physe.2015.03.003  0.418
2015 Kumar V, Shah EV, Roy DR. DFT investigation on A4B4 (A=Cu, Ag; B=As, Sn) metal–semiconductor alloy clusters for potential nanomaterials Physica E: Low-Dimensional Systems and Nanostructures. 68: 224-231. DOI: 10.1016/J.Physe.2014.12.020  0.654
2014 Shah EV, Roy DR. A comparative DFT study on electronic, thermodynamic and optical properties of telluride compounds Computational Materials Science. 88: 156-162. DOI: 10.1016/J.Commatsci.2014.03.013  0.683
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