Cover Image, Volume 113, Issue 24.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. i, doi. 10.1002/qua.24570
- Publication type:
- Article
Works matching IS 00207608 AND DT 2013 AND VI 113 AND IP 24
Results: 12
1
2
Base pairing patterns of DNA base lesion spiroiminodihydantoin: A DFT study.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2600, doi. 10.1002/qua.24512
- By:
- Publication type:
- Article
3
Theoretical study of the triplet state aryl cations recombination: A possible route to unusually stable doubly charged biphenyl cations.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2580, doi. 10.1002/qua.24509
- By:
- Publication type:
- Article
4
Emerging polymorphism in nanostructured TiO<sub>2</sub>: Quantum chemical comparison of anatase, rutile, and brookite clusters.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2611, doi. 10.1002/qua.24522
- By:
- Publication type:
- Article
5
Complex-scaling calculations for resonance states of he with screened coulomb potentials.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2569, doi. 10.1002/qua.24504
- By:
- Publication type:
- Article
6
Information-theoretical analysis for the S<sub>N</sub>2 exchange reaction CH<sub>3</sub>Cl + F<sup>−</sup>.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2589, doi. 10.1002/qua.24510
- By:
- Publication type:
- Article
7
Comment on 'CCSD study of anharmonic Raman cross sections of fundamental, overtone, and combination transitions'.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2634, doi. 10.1002/qua.24514
- By:
- Publication type:
- Article
8
A comparison of attack angle dependence of exchange channel of reaction H + HS (v = 0, 1; j = 0) on 3A″ and 3A′ surfaces.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2629, doi. 10.1002/qua.24525
- By:
- Publication type:
- Article
9
Inside Cover, Volume 113, Issue 24.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. iii, doi. 10.1002/qua.24571
- Publication type:
- Article
10
Reply to the comment on 'CCSD study of anharmonic Raman cross sections of fundamental, overtone, and combination transitions'.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2637, doi. 10.1002/qua.24513
- By:
- Publication type:
- Article
11
The electronic structures and charge transfer properties of tetra(naphthalene-dione)porphyrins and tetra(naphthalene-dithione)porphyrins as dye-sensitized solar cell skeleton.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2605, doi. 10.1002/qua.24517
- By:
- Publication type:
- Article
12
Density functional theory investigation of the binding interactions between phosphoryl, carbonyl, imino, and thiocarbonyl ligands and the pentaaqua nickel(II) complex: Coordination affinity and associated parameters.
- Published in:
- International Journal of Quantum Chemistry, 2013, v. 113, n. 24, p. 2621, doi. 10.1002/qua.24524
- By:
- Publication type:
- Article