Found: 18
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Theoretical and experimental approach on investigation of ethylurea-water clusters.
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- Zeitschrift für Physikalische Chemie, 2024, v. 238, n. 4, p. 683, doi. 10.1515/zpch-2023-0381
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- Article
Noncovalent interactions in N-methylurea crystalline hydrates.
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- Zeitschrift für Physikalische Chemie, 2024, v. 238, n. 1, p. 89, doi. 10.1515/zpch-2023-0345
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- Article
SULFATION OF BIRCH WOOD XYLAN WITH SULFAMIC ACID IN THE PRESENCE OF ACTIVATORS: EXPERIMENT AND THEORY.
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- Cellulose Chemistry & Technology, 2023, v. 57, n. 9/10, p. 963, doi. 10.35812/cellulosechemtechnol.2023.57.85
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- Article
Effect of solvents on intra- and inter-molecular interactions of oligothiophenes.
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- Journal of Molecular Modeling, 2023, v. 29, n. 9, p. 1, doi. 10.1007/s00894-023-05684-4
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- Article
Nanographene‐Doped Chalcone Derivatives of Dioxybiphenyl‐Bridged Dispirocyclotriphosphazenes: Synthesis, Electrical Properties, and DFT Calculations.
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- ChemistrySelect, 2023, v. 8, n. 28, p. 1, doi. 10.1002/slct.202300962
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- Article
Molecular Structure, Electronic Properties, Reactivity (ELF, LOL, and Fukui), and NCI-RDG Studies of the Binary Mixture of Water and Essential Oil of Phlomis bruguieri.
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- Molecules, 2023, v. 28, n. 6, p. 2684, doi. 10.3390/molecules28062684
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- Article
Comprehensive Study of the Ammonium Sulfamate–Urea Binary System.
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- Molecules, 2023, v. 28, n. 2, p. 470, doi. 10.3390/molecules28020470
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- Article
A Comprehensive Study of N-Butyl-1H-Benzimidazole.
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- Molecules, 2022, v. 27, n. 22, p. 7864, doi. 10.3390/molecules27227864
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- Article
An Experimental and Theoretical Study on Essential Oil of Aethionema sancakense : Characterization, Molecular Properties and RDG Analysis.
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- Molecules, 2022, v. 27, n. 18, p. 6129, doi. 10.3390/molecules27186129
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- Article
Sulfation of Wheat Straw Soda Lignin with Sulfamic Acid over Solid Catalysts.
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- Polymers (20734360), 2022, v. 14, n. 15, p. 3000, doi. 10.3390/polym14153000
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- Article
Synthesis of Cinnamoyl‐Amino Acid Ester Derivatives and Structure‐Activity Relationship Based on Thermal Stability, Dielectric, and Theoretical Analysis.
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- ChemistrySelect, 2022, v. 7, n. 20, p. 1, doi. 10.1002/slct.202200895
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- Article
Catalytic Sulfation of Betulin with Sulfamic Acid: Experiment and DFT Calculation.
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- International Journal of Molecular Sciences, 2022, v. 23, n. 3, p. 1602, doi. 10.3390/ijms23031602
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- Article
Theoretical and experimental study of guar gum sulfation.
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- Journal of Molecular Modeling, 2021, v. 27, n. 1, p. 1, doi. 10.1007/s00894-020-04645-5
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- Article
Intermolecular hydrogen bond interactions in the thiourea/water complexes (Thio-(H2O)n) (n = 1, ..., 5): X-ray, DFT, NBO, AIM, and RDG analyses.
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- Journal of Molecular Modeling, 2020, v. 26, n. 6, p. 1, doi. 10.1007/s00894-020-04423-3
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- Article
Determination of effective atomic numbers and electron densities from mass attenuation coefficients for some selected complexes containing lanthanides.
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- Canadian Journal of Physics, 2017, v. 95, n. 10, p. 1005, doi. 10.1139/cjp-2016-0811
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- Article
Experimental and theoretical investigation of molecular structure, vibrational analysis, chemical reactivity, electrostatic potential of benzyl methacrylate monomer and homopolymer.
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- Canadian Journal of Physics, 2016, v. 94, n. 9, p. 853, doi. 10.1139/cjp-2016-0252
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- Article
Spectroscopic investigation, HOMO-LUMO energies, natural bond orbital (NBO) analysis and thermodynamic properties of two-armed macroinitiator containing coumarin with DFT quantum chemical calculations.
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- Canadian Journal of Physics, 2016, v. 94, n. 6, p. 583, doi. 10.1139/cjp-2016-0041
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- Article
Density functional theory (DFT) and Hartree-Fock (HF) calculations of potential p-vinylbenzyl chloride-based macroinitiator for atom transfer radical polymerization.
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- Canadian Journal of Physics, 2016, v. 94, n. 3, p. 290, doi. 10.1139/cjp-2015-0665
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- Article