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1
المؤلفون: B.S. Arun Sasi, Sutheertha S. Nair, Bibin K. Jose, C. James, D. Sajan
المصدر: Journal of the Indian Chemical Society. 99:100624
مصطلحات موضوعية: Inorganic Chemistry, Organic Chemistry, Drug Discovery, Electrochemistry, Physical and Theoretical Chemistry
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::0f5bfade675eebeab1d5e34d231a2e47
https://doi.org/10.1016/j.jics.2022.100624 -
2
المؤلفون: C. James, S. Alen, B.S. Arun Sasi, Lija K. Joy, D. Sajan
المصدر: Journal of Materials Science: Materials in Electronics. 29:17887-17902
مصطلحات موضوعية: Materials science, Intermolecular force, Hyperpolarizability, 02 engineering and technology, Electronic structure, 010402 general chemistry, 021001 nanoscience & nanotechnology, Condensed Matter Physics, 01 natural sciences, Atomic and Molecular Physics, and Optics, 0104 chemical sciences, Electronic, Optical and Magnetic Materials, Molecular geometry, Polarizability, Chemical physics, Density functional theory, Electrical and Electronic Engineering, 0210 nano-technology, Single crystal, Natural bond orbital
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3
المؤلفون: B.S. Arun Sasi, C. James, R.P. Jebin, T. Suthan
المصدر: Journal of Molecular Structure. 1146:797-807
مصطلحات موضوعية: Electron density, Chemistry, Organic Chemistry, Analytical chemistry, 02 engineering and technology, 010402 general chemistry, 01 natural sciences, Evaporation (deposition), Electron localization function, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, Benzaldehyde, chemistry.chemical_compound, Delocalized electron, Intramolecular force, 0202 electrical engineering, electronic engineering, information engineering, Molecule, Physical chemistry, 020201 artificial intelligence & image processing, Spectroscopy, Natural bond orbital
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4
المؤلفون: A.R. Twinkle, B.S. Arun Sasi, C. James
المصدر: Journal of Molecular Structure. 1141:524-534
مصطلحات موضوعية: Electron density, 010405 organic chemistry, Hydrogen bond, Dimer, Organic Chemistry, 010402 general chemistry, 01 natural sciences, Electron localization function, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, chemistry.chemical_compound, Delocalized electron, Crystallography, Nitroxoline, chemistry, Computational chemistry, Molecule, Spectroscopy, Natural bond orbital
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5
المؤلفون: S. Balachandran, Jesby George, A. Ronaldo Anuf, N. Suma, I. Hubert Joe, G.P. Sheeja Mol, B.S. Arun Sasi, D. Aruldhas
المصدر: Journal of Molecular Structure. 1221:128866
مصطلحات موضوعية: 010405 organic chemistry, Chemistry, Hydrogen bond, Organic Chemistry, Intermolecular force, Dihedral angle, 010402 general chemistry, 01 natural sciences, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, Molecular dynamics, Potential energy surface, Physical chemistry, Molecule, Solvent effects, Spectroscopy, Natural bond orbital
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6
المؤلفون: B.S. Arun Sasi, D. Aruldhas, I. Hubert Joe, A. Beta Daniel
المصدر: Journal of Molecular Structure. 1218:128503
مصطلحات موضوعية: 010405 organic chemistry, Chemistry, Organic Chemistry, Binding energy, 010402 general chemistry, Energy minimization, 01 natural sciences, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, Computational chemistry, Intramolecular force, Potential energy surface, Molecule, Molecular orbital, Spectroscopy, Basis set, Natural bond orbital
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7
المؤلفون: C. James, K.C. Bright, B.S. Arun Sasi
المصدر: Journal of Molecular Structure. 1103:286-294
مصطلحات موضوعية: education.field_of_study, Chemistry, Hydrogen bond, Organic Chemistry, Population, 02 engineering and technology, 010402 general chemistry, 021001 nanoscience & nanotechnology, 01 natural sciences, Electron localization function, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, Delocalized electron, Computational chemistry, Intramolecular force, Molecule, Physical chemistry, Density functional theory, 0210 nano-technology, education, Spectroscopy, Natural bond orbital
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8
المؤلفون: N. Suma, A. Ronaldo Anuf, B.S. Arun Sasi, D. Aruldhas, I. Hubert Joe
المصدر: Journal of Molecular Structure. 1206:127677
مصطلحات موضوعية: 010405 organic chemistry, Chemistry, Hydrogen bond, Organic Chemistry, 010402 general chemistry, 01 natural sciences, 0104 chemical sciences, Analytical Chemistry, Inorganic Chemistry, Molecular dynamics, chemistry.chemical_compound, Docking (molecular), Computational chemistry, Pyridine, Density functional theory, Solvent effects, Conformational isomerism, Spectroscopy, Natural bond orbital
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9
المؤلفون: R. Reshmy, K. Kurien Thomas, Yusuf Erdogdu, B.S. Arun Sasi, Lynnette Joseph, D. Sajan
المساهمون: Kırşehir Ahi Evran Üniversitesi, Fen-Edebiyat Fakültesi, Fizik Bölümü
مصطلحات موضوعية: Models, Molecular, Electron density, Analytical chemistry, FT-IR and FT-Raman spectra, Molecular Conformation, Spectrum Analysis, Raman, Molecular physics, Analytical Chemistry, 3-acetyl-7-methoxycoumarin, symbols.namesake, Atomic orbital, Coumarins, NBO, Spectroscopy, Fourier Transform Infrared, Molecule, Instrumentation, Spectroscopy, Basis set, PED, Chemistry, Electrostatic potential, Charge density, Atomic and Molecular Physics, and Optics, NMR spectra database, symbols, Quantum Theory, Raman spectroscopy, Natural bond orbital
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7b112805a65a16921263e65e2d4b330c
https://avesis.gazi.edu.tr/publication/details/d82eef11-d946-46bf-8daa-8de6925e6af1/oai -
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