Dr Nityananda Sahu

vidwan id: 527060

Male

Assistant Professor, Department of Chemistry
Indian Institute of Technology Jammu

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Expertise

Applied Physics

Publications

Total Articles 19

Books 0

Proceedings 0

Publications

Scopus

Citations 600

h-index 12

CrossRef

Citations 309

h-index 9

Google Scholar

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Bio

Theoretical and Computational Chemistry

Personal Details

Male
Assistant Professor , Indian Institute of Technology Jammu
IIT Jammu, Jagti, Nagrota

PhD

Indian Institute of Technology Kanpur 2016

Assistant Professor May 2024 – Present

Indian Institute of Technology Jammu | Department of Chemistry

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Co-Authors (5)

Dr Shridhar R Gadre

N/A

Prof Gurmeet Singh

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Dr K V Jovan Jose

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Dr Pradipta Bandyopadhyay

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Scholarly Work

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Scholarly Publications

Toward an Accurate and Inexpensive Estimation of CCSD(T)/CBS Binding Energies of Large Water Clusters

Open Access

Article

Year: 2016. Volume: 120 , Issue: 28 , Pages: 5706-5714 .

Authors: Sahu N.;Singh G.;Nandi A.;Gadre S.R.

10.1021/acs.jpca.6b04519

Vibrational infrared and Raman spectra of polypeptides: Fragments-in-fragments within molecular tailoring approach

Open Access

Article

Year: 2016. Volume: 144 , Issue: 11 .

Authors: Sahu N.;Gadre S.

10.1063/1.4943966

Accurate vibrational spectra via molecular tailoring approach: A case study of water clusters at MP2 level

Open Access

Article

Year: 2015. Volume: 142 , Issue: 1 .

Authors: Sahu N.;Gadre S.

10.1063/1.4905004

Structures, energetics and vibrational spectra of (H2O)32 clusters: A journey from model potentials to correlated theory

Open Access

Article

Molecular Physics. Year: 2015. Volume: 113 , Issue: 19-20 , Pages: 2970-2979 .

Authors: Sahu N.;Khire S.S.;Gadre S.R.

10.1080/00268976.2015.1062150

Molecular tailoring approach: A route for ab initio treatment of large clusters

Open Access

Article

Chemical Reviews. Year: 2014. Volume: 47 , Issue: 9 , Pages: 2739-2747 .

Authors: Sahu N.;Gadre S.R.

10.1021/ar500079b

119

Quantum chemical investigations on molecular clusters

Open Access

Review

Chemical Reviews. Year: 2014. Volume: 114 , Issue: 24 , Pages: 12132-12173 .

Authors: Gadre S.R.;Yeole S.D.;Sahu N.

10.1021/cr4006632

184

Low energy isomers of (H2O)25 from a hierarchical method based on Monte Carlo temperature basin paving and molecular tailoring approaches benchmarked by MP2 calculations

Open Access

Article

Year: 2014. Volume: 141 , Issue: 16 .

Authors: Sahu N.;Gadre S.R.;Rakshit A.;Bandyopadhyay P.;Miliordos E.;Xantheas S.S.

10.1063/1.4897535

High-level ab initio investigations on structures and energetics of N 2O clusters

Open Access

Article

Year: 2013. Volume: 117 , Issue: 36 , Pages: 8591-8598 .

Authors: Yeole S.;Sahu N.;Gadre S.

10.1021/jp402649y

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