Theoretical study of the reaction of Cr<sup>+</sup> with SCO in gas phase.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1598, doi. 10.1002/qua.21286
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 2007 AND VI 107 AND IP 7
Results: 14
1
2
Hammett MSP and Taft DSP analysis of substituent effects on Mulliken charges of 1-(arylmethylene)-1H-cyclopropanaphthalene.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1574, doi. 10.1002/qua.21293
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- Publication type:
- Article
3
Blue-shifted H-bond in aromatic sulfines: An ab initio calculation.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1559, doi. 10.1002/qua.21295
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- Publication type:
- Article
4
Electronic structures and spectra of porphyrin with fused benzoheterocycles: DFT and TDDFT-PCM investigations.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1614, doi. 10.1002/qua.21296
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- Publication type:
- Article
5
New lower bound formula from the local energy.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1543, doi. 10.1002/qua.21297
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- Publication type:
- Article
6
NO migration from N-methyl-N-nitrosobenzene-sulfonamide to 3,6-dibromocarbazole: Concerted or stepwise reaction path?
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1585, doi. 10.1002/qua.21299
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- Publication type:
- Article
7
Water solvent and local anesthetics: A computational study.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1642, doi. 10.1002/qua.21300
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- Publication type:
- Article
8
Quantum wave packet dynamics on multidimensional adaptive grids: Applications of the moving boundary truncation method.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1566, doi. 10.1002/qua.21301
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- Publication type:
- Article
9
Ring opening of boriranes vis-à-vis aziridines: An ab initio and DFT probe on the mechanisms.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1590, doi. 10.1002/qua.21302
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- Publication type:
- Article
10
Density functional study of carbon monoxide adsorption on small cationic, neutral, and anionic aluminum nitride clusters.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1624, doi. 10.1002/qua.21303
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- Publication type:
- Article
11
Multipole expansions for numerical orbital products.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1578, doi. 10.1002/qua.21308
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- Publication type:
- Article
12
Highly accurate solutions for the confined hydrogen atom.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1548, doi. 10.1002/qua.21313
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- Publication type:
- Article
13
First principles study of small palladium cluster growth and isomerization.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1632, doi. 10.1002/qua.21315
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- Publication type:
- Article
14
Algebraic approach to radial ladder operators in the hydrogen atom.
- Published in:
- International Journal of Quantum Chemistry, 2007, v. 107, n. 7, p. 1608, doi. 10.1002/qua.21317
- By:
- Publication type:
- Article