Laudatio for Ivan Černušák.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27273
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- Article
Works matching IS 00207608 AND DT 2023 AND VI 123 AND IP 24
Results: 9
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On energetics of proton and electron transfer of selected phenol derivatives: Theoretical investigation of radical and oxonium cations.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27176
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- Article
3
Excited states of aurocarbons: CASPT2 and CCSD(T) calculations of C<sub>2</sub>Au<sub>2</sub> and C<sub>2</sub>Au<sub>4</sub>.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27122
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- Article
4
Thermal isomerization of phenylazoindoles: Inversion or rotation? That is the question.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27120
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- Publication type:
- Article
5
Advances and critical assessment of machine learning techniques for prediction of docking scores.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27110
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- Article
6
Limonene: A scented and versatile tropospheric free radical deactivator.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27103
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- Article
7
A theoretical adsorption study of the inner‐core and outer‐core hydrated alkali metal cation–circumcoronene complexes.
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- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27100
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- Article
8
SVECV‐f12: A composite scheme for accurate and cost‐effective evaluation of reaction barriers. II. Benchmarking using Karton's BH28 barrier heights database.
- Published in:
- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.27069
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- Publication type:
- Article
9
Issue Information.
- Published in:
- International Journal of Quantum Chemistry, 2023, v. 123, n. 24, p. 1, doi. 10.1002/qua.26949
- Publication type:
- Article