The effects of strain and charge doping on the electronic properties of graphitic C<sub>3</sub>N<sub>5</sub>.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26378
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 2020 AND VI 120 AND IP 22
Results: 15
1
2
Designing spirobifullerene core based three‐dimensional cross shape acceptor materials with promising photovoltaic properties for high‐efficiency organic solar cells.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26377
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- Publication type:
- Article
3
Issue Information.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26506
- Publication type:
- Article
4
Theoretical calculation of positron annihilation spectrum using positron‐electron correlation‐polarization potential.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26376
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- Publication type:
- Article
5
Revisiting (anti)aromaticity and chemical bond in planar B<sub>X</sub>N<sub>X</sub> clusters (x = 2‐11).
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26403
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- Publication type:
- Article
6
Shannon entropy as a predictor of avoided crossing in confined atoms.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26374
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- Publication type:
- Article
7
Cover Image, Volume 120, Issue 22.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26505
- Publication type:
- Article
8
A general penalty method for density‐to‐potential inversion.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26400
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- Publication type:
- Article
9
First‐principles investigation of structural, electronic, and optical properties of transition metal‐doped C40 CrSi<sub>2</sub>.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26401
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- Publication type:
- Article
10
Hierarchical equations of motion in the Libra software package.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26373
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- Publication type:
- Article
11
Quantum mechanical modeling of Zn‐based spinel oxides: Assessing the structural, vibrational, and electronic properties.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26368
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- Publication type:
- Article
12
Conjugated‐carbon nanostructures: Emergences.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26367
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- Publication type:
- Article
13
Theoretical studies on the influence of metallic cations on ring opening of propylene oxide catalyzed by metal‐salen complexes.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26366
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- Publication type:
- Article
14
Strain‐tunable electronic properties and optical properties of Hf<sub>2</sub>CO<sub>2</sub> MXene.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26365
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- Publication type:
- Article
15
Topology delimited radical‐scavenging propensity of monohydroxycinnamic acids.
- Published in:
- International Journal of Quantum Chemistry, 2020, v. 120, n. 22, p. 1, doi. 10.1002/qua.26329
- By:
- Publication type:
- Article