Cover Image, Volume 119, Issue 21.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26050
- Publication type:
- Article
Works matching IS 00207608 AND DT 2019 AND VI 119 AND IP 21
Results: 10
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vdW‐TSSCDS—An automated and global procedure for the computation of stationary points on intermolecular potential energy surfaces.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26008
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- Publication type:
- Article
3
Quantification of electron correlation effects: Quantum Information Theory vs Method of Increments.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26007
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- Publication type:
- Article
4
Computing weighted Szeged and PI indices from quotient graphs.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26006
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- Publication type:
- Article
5
Small Janus dimer as electric field manipulated molecular clam switch and electric information storage unit.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26005
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- Publication type:
- Article
6
Electronic factors determining the methane bond breaking process on small aluminum clusters.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26003
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- Publication type:
- Article
7
Benchmark calculations of intramolecular hydrogen bond energy based on molecular tailoring and function‐based approaches: Developing hybrid approach.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26001
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- Publication type:
- Article
8
Crystallographic and first‐principles density functional theory study on the structure, noncovalent interactions, and chemical reactivity of 1,5‐benzodiazepin‐2‐ones derivatives.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.26000
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- Publication type:
- Article
9
Formic acid catalyzed keto‐enol tautomerizations for C<sub>2</sub> and C<sub>3</sub> enols: Implications in atmospheric and combustion chemistry.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.25954
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- Publication type:
- Article
10
Issue Information.
- Published in:
- International Journal of Quantum Chemistry, 2019, v. 119, n. 21, p. N.PAG, doi. 10.1002/qua.25750
- Publication type:
- Article