Dhanoj Gupta

Dr. Dhanoj Gupta

Vellore Institute of Technology, Vellore, Vellore, India
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Research Focus & Metrics

Academic Career Length

14Years (2013-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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4 August 2014 in The Journal of Chemical Physics
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Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
BABOBBY ANTONY
BOBBY ANTONY
The theoretical calculations of electron impact total ionization cross section for cycloalkane, aldehyde, and ketone group molecules are undertaken from ionization threshold to 2 keV. The present calculations are based on the spherical complex optical potential formalism and complex scattering potential ionization contribution method. The results of most of the targets studied compare fairly well with the recent measurements, wherever available and the cross sections for many targets are predicted for the first time. The correlation between the peak of ionization cross sections with number of target electrons and target parameters is also reported. It was found that the cross sections at their maximum depend linearly with the number of target electrons and with other target parameters, confirming the consistency of the values reported here.

13 April 2017 in The European Physical Journal D
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Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
HCHeechol Choi
Heechol Choi
MSMi-Young Song
Mi-Young Song
GRZEGORZ KARWASZGRZEGORZ KARWASZ
GRZEGORZ KARWASZ
JYJung-Sik Yoon
Jung-Sik Yoon

13 February 2019 in The Journal of Chemical Physics
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Journal Article
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Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
HCHeechol Choi
Heechol Choi
SSSuvam Singh
Suvam Singh
PMParesh Modak
Paresh Modak
BABOBBY ANTONY
BOBBY ANTONY
JYJung-Sik Yoon
Jung-Sik Yoon
Two independent methods, namely, Binary-encounter Bethe (BEB) and complex scattering potential-ionization contribution (CSP-ic) methods, are employed to calculate the total ionization cross section (Qion) for cyclic organic molecules from ionization threshold to 5 keV for which there is a paucity of data in the literature. The Qion calculated with the (BEB/ωB97X) combination is found to give good agreement with the experimental results, the CSP-ic method, and the Qion calculated from Irikura orbital energies. The Qion for most of the targets are calculated for the first time over such a wide energy range. Hence, to check the consistency and reliability of the present data, we have also computed the static polarizability for all the targets and the variation of maximum ionization cross section (Qion,max) with polarizability is studied. A linear relationship is observed between these quantities indicating the consistency and reliability of the present Qion data. The targets studied are important for industrial applications, radiation biology, and astrophysics.

5 September 2013 in Molecular Physics
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Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
RNRahla Naghma
Rahla Naghma
BABOBBY ANTONY
BOBBY ANTONY

1 March 2014 in International Journal of Mass Spectrometry
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RNRahla Naghma
Rahla Naghma
Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
BGBiplab Goswami
Biplab Goswami
BABOBBY ANTONY
BOBBY ANTONY

3 June 2013 in Physical Review A
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ABAvani Barot
Avani Barot
Dhanoj GuptaDhanoj Gupta
Dhanoj Gupta
MVMinaxi Vinodkumar
Minaxi Vinodkumar
BABOBBY ANTONY
BOBBY ANTONY
In the present article we report a comprehensive calculation of total and differential cross sections for electron impact on allene (C3H4) molecule. The total cross sections are computed for a wide electron energy range from 0.1 eV to 2 keV. We have employed R-matrix code through quantemol-n software for ab initio calculations below 10 eV while intermediate- to high-energy calculations are performed using the spherical complex optical potential formalism. The two methods are found to be consistent at around 3 eV, merging smoothly. The results for both total and differential cross sections are in good agreement with previous results wherever available. We have also observed the presence of a shape resonance at 2.9 eV due to degenerate (2 B1, 2 B2) states. The electronic excitation cross section for e-C3H4 scattering is reported.