| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Adsorption and surface diffusion of silicon growth species in silicon carbide chemical vapour deposition processes studied by quantum-chemical computations
|
Kalered, Emil
|
|
2013
|
132 |
12 |
p. 1-10
|
artikel
|
| 2 |
All electron ab initio calculations on the ScTi molecule: a really hard nut to crack
|
Kalemos, Apostolos
|
|
2013
|
132 |
12 |
p. 1-9
|
artikel
|
| 3 |
Assessing the performances of some recently proposed density functionals for the description of organometallic structures
|
Brémond, Éric
|
|
2013
|
132 |
12 |
p. 1-12
|
artikel
|
| 4 |
Computational investigation of surface reactivity of functionalized silicon surfaces in deposition processes
|
Lin, Jia-Ming
|
|
2013
|
132 |
12 |
p. 1-14
|
artikel
|
| 5 |
Insights into the hydrolytic chemistry of molybdocene dichloride based on a theoretical mechanistic study
|
Suárez, Dimas
|
|
2013
|
132 |
12 |
p. 1-11
|
artikel
|
| 6 |
Ionization of ammonium dinitramide: decomposition pathways and ionization products
|
Kleimark, Jonatan
|
|
2013
|
132 |
12 |
p. 1-9
|
artikel
|
| 7 |
Modeling continuous changes in substituent electronegativity and chemical hardness using fictitious nuclear potentials
|
Janesko, Benjamin G.
|
|
2013
|
132 |
12 |
p. 1-12
|
artikel
|
| 8 |
MULTIMODE calculations of the infrared spectra of H7+ and D7+ using ab initio potential energy and dipole moment surfaces
|
Qu, Chen
|
|
2013
|
132 |
12 |
p. 1-7
|
artikel
|
| 9 |
Multipole moments from the partition–expansion method
|
López, Rafael
|
|
2013
|
132 |
12 |
p. 1-10
|
artikel
|
| 10 |
The two-component quantum theory of atoms in molecules (TC-QTAIM): the unified theory of localization/delocalization of electrons, nuclei, and exotic elementary particles
|
Goli, Mohammad
|
|
2013
|
132 |
12 |
p. 1-22
|
artikel
|
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