Radiative association of P and Cl atoms.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02606-y
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Works matching IS 1432881X AND DT 2020 AND VI 139 AND IP 6
Results: 8
1
2
Non-planarity in four-membered homo-cyclic compounds A4 (A = O, S, Se, Te, Po) and restoring their planarity: a study of the pseudo-Jahn–Teller effect.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02615-x
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- Article
3
Mechanism of hydrogen generation on stable Mo-edge of 2H-MoS2 in water from density functional theory.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02614-y
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- Publication type:
- Article
4
Rate rules for hydrogen abstraction reaction kinetics of polycyclic aromatic hydrocarbons and vinyl radical.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02612-0
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- Publication type:
- Article
5
Carboxymethylcellulose and cellulose xanthate matrices as potential adsorbent material for potentially toxic Cr3+, Cu2+ and Cd2+metal ions: a theoretical study.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02610-2
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- Article
6
A computational study on phenibut lactamization mechanism and the pH effects on the process.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02617-9
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- Article
7
A DFT and wave function theory study of hydrogen adsorption on small beryllium oxide clusters.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02605-z
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- Publication type:
- Article
8
Bonding analysis of the effect of strain on trigger bonds in organic-cage energetic materials.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 6, p. 1, doi. 10.1007/s00214-020-02604-0
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- Publication type:
- Article