Personal profile
Research Interests
Computational Chemistry and spans many areas of Chemistry. These include Organic Chemistry, Photo Chemistry, Atmospheric and Interstellar Chemistry, Biochemistry, Dyes and Pigments, Catalysis, Nonlinear Optics and Molecular Electronics, etc. As in these days the interaction between theory and experiment is becoming more and more intimate, my current research focuses on giving theoretical explanation to experimental findings.
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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SDG 3 Good Health and Well-being -
SDG 7 Affordable and Clean Energy
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Dive into the research topics where Sanyasi Sitha is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Collaborations and top research areas from the last five years
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Research output
- 50 Article
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Better performances of benzene-based over thiophene-based aromatic anionic donors: Computational studies on metameric conformational selectivity and hyperpolarizability of organic inner salts
Sitha, S., Apr 2024, In: Journal of Physical Organic Chemistry. 37, 4, e4598.Research output: Contribution to journal › Article › peer-review
Open Access6 Citations (Scopus) -
Efficient Chromophore Design with PICT Coupled TICT: Computational Studies on Hyperpolarizabilities of Pyridinium Benzimidazolates
Sitha, S., 26 Jul 2024, In: ChemistrySelect. 9, 28, e202402075.Research output: Contribution to journal › Article › peer-review
Open Access -
Enhanced Hyperpolarizabilities Through p-Phenylene Bridges: Computational Studies on Metamerism and Functional Molecular Properties of Pyridinium–Dicyanomethanide-Based Zwitterions
Sitha, S., Dec 2024, In: Journal of Physical Organic Chemistry. 37, 12, e4657.Research output: Contribution to journal › Article › peer-review
Open Access3 Citations (Scopus) -
Enhanced molecular first hyperpolarizabilities with Reichardt’s type of zwitterions: a computational study on roles of various monocyclic aromatic bridges
Pant, D. & Sitha, S., Aug 2024, In: Journal of Molecular Modeling. 30, 8, 284.Research output: Contribution to journal › Article › peer-review
Open Access1 Citation (Scopus) -
Enhanced optoelectronic properties with aromatic bridges: A computational study on N-methyl pyridinium and phenolate types of push-pull zwitterions
Pant, D. & Sitha, S., 5 Jan 2024, In: International Journal of Quantum Chemistry. 124, 1, e27317.Research output: Contribution to journal › Article › peer-review
Open Access6 Citations (Scopus)