Works matching IS 1432881X AND DT 2024 AND VI 143 AND IP 2
Results: 9
A DFT study on spring property of helicenes.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-024-03093-1
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- Publication type:
- Article
Using first-principles study on the characteristics of γ-GeSe as anode of sodium-ion battery.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-024-03092-2
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- Article
Foreword for the Festschrift on the occasion of the 65th birthday of Professor Pratim Kumar Chattaraj.
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- 2024
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- Publication type:
- Proceeding
Three isoelectronic families of X4Y4 cubic systems.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-024-03091-3
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- Article
Evaluation of picture change effects on fractional occupation number states in noble gas atoms.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-023-03089-3
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- Publication type:
- Article
Decoding the impact of solvents in altering the conversion rates and stereoselectivity in proline-catalyzed asymmetric aldol reaction.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-023-03088-4
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- Publication type:
- Article
Computational insights on the adsorption of glycine, methionine, tyrosine and phenylalanine on the zinc oxide nanocluster Zn<sub>12</sub>O<sub>12</sub>.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-023-03087-5
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- Article
Insight into solvent-polarity-regulated photoinduced excited state behaviors for E-HBT fluorophore: a theoretical investigation.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-023-03086-6
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- Article
Computational design of a molecularly imprinted polymer to cyhalothrin.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2024, v. 143, n. 2, p. 1, doi. 10.1007/s00214-023-03085-7
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- Publication type:
- Article