| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
A study of the compactness of wave functions based on Shannon entropy indices: a seniority number approach
|
Lain, Luis
|
|
2015
|
134 |
7 |
p. 1-7
|
article
|
| 2 |
CO adsorption complexes in zeolites: How does the inclusion of dispersion interactions affect predictions made from DFT calculations? The case of Na-CHA
|
Fischer, Michael
|
|
2015
|
134 |
7 |
p. 1-18
|
article
|
| 3 |
Complexes of nitric oxide with water and imidazole
|
Martinez Gonzalez, Marco
|
|
2015
|
134 |
7 |
p. 1-12
|
article
|
| 4 |
Computational investigation on the intramolecular resonance-inhibited hydrogen bonding: a new type of interaction versus the RAHB model
|
Masumian, Ehsan
|
|
2015
|
134 |
7 |
p. 1-11
|
article
|
| 5 |
Designing a paradigm for parameter-free double-hybrid density functionals through the adiabatic connection path
|
Alipour, Mojtaba
|
|
2015
|
134 |
7 |
p. 1-8
|
article
|
| 6 |
Effects of monohydration on an adenine–thymine base pair
|
Watanabe, Sara
|
|
2015
|
134 |
7 |
p. 1-12
|
article
|
| 7 |
Electron density Laplacian and halogen bonds
|
Tognetti, Vincent
|
|
2015
|
134 |
7 |
p. 1-10
|
article
|
| 8 |
Europium-doped silicon clusters EuSin (n = 3–11) and their anions: structures, thermochemistry, electron affinities, and magnetic moments
|
Yang, Jucai
|
|
2015
|
134 |
7 |
p. 1-11
|
article
|
| 9 |
Hermitian “chemical” Hamiltonian: an alternative ab initio method
|
Mayer, I.
|
|
2015
|
134 |
7 |
p. 1-10
|
article
|
| 10 |
Isotope effects on the formation of the lowest rovibrational level of NaH molecule via pump–dump photoassociation
|
Wang, Bin-Bin
|
|
2015
|
134 |
7 |
p. 1-10
|
article
|
| 11 |
The effects of internal molecular dynamics on the evaporation/condensation of n-dodecane
|
Nasiri, Rasoul
|
|
2015
|
134 |
7 |
p. 1-12
|
article
|
| 12 |
Theoretical study on photophysical properties of multifunctional star-shaped molecules with 1,8-naphthalimide core for organic light-emitting diode and organic solar cell application
|
Jin, Ruifa
|
|
2015
|
134 |
7 |
p. 1-13
|
article
|
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