Works matching IS 01928651 AND DT 2015 AND VI 36 AND IP 29
Results: 9
Erratum: Theoretical analysis of excited states and energy transfer mechanism in conjugated dendrimers.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2208, doi. 10.1002/jcc.24041
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- Publication type:
- Article
Cover Image, Volume 36, Issue 29.
- Published in:
- 2015
- Publication type:
- Other
p K<sub>A</sub> in proteins solving the Poisson- Boltzmann equation with finite elements.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2147, doi. 10.1002/jcc.24053
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- Publication type:
- Article
Aqueous acidities of primary benzenesulfonamides: Quantum chemical predictions based on density functional theory and SMD.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2158, doi. 10.1002/jcc.23998
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- Publication type:
- Article
A coupled-cluster study on the noble gas binding ability of metal cyanides versus metal halides (metal = Cu, Ag, Au).
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2168, doi. 10.1002/jcc.24190
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- Publication type:
- Article
The Py PES library of high quality semi-global potential energy surfaces.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2200, doi. 10.1002/jcc.24192
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- Publication type:
- Article
Does enhanced oxygen activation always facilitate CO oxidation on gold clusters?
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2177, doi. 10.1002/jcc.24194
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- Publication type:
- Article
Efficient 'On-the-Fly' calculation of Raman Spectra from Ab-Initio molecular dynamics: Application to hydrophobic/hydrophilic solutes in bulk water.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2188, doi. 10.1002/jcc.24198
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- Publication type:
- Article
Germanium, carbon-germanium, and silicon-germanium triangulenes.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 29, p. 2193, doi. 10.1002/jcc.24199
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- Publication type:
- Article