| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A full-dimensional time-dependent wave packet study of the OH + CO → H + CO2 reaction
|
Liu, Shu
|
|
2012
|
131 |
1 |
p. 1-7
|
artikel
|
| 2 |
Calculation of the zero-point energy from imaginary-time quantum trajectory dynamics in Cartesian coordinates
|
Garashchuk, Sophya
|
|
2012
|
131 |
1 |
p. 1-10
|
artikel
|
| 3 |
Chemical accuracy in ab initio thermochemistry and spectroscopy: current strategies and future challenges
|
Peterson, Kirk A.
|
|
2012
|
131 |
1 |
p. 1-20
|
artikel
|
| 4 |
Computational modeling of extended systems
|
DiLabio, Gino A.
|
|
2012
|
131 |
1 |
p. 1-2
|
artikel
|
| 5 |
Conduction modulation of π-stacked ethylbenzene wires on Si(100) with substituent groups
|
Smeu, Manuel
|
|
2012
|
131 |
1 |
p. 1-8
|
artikel
|
| 6 |
Dynamics of collisions of hydroxyl radicals with fluorinated self-assembled monolayers
|
Troya, Diego
|
|
2012
|
131 |
1 |
p. 1-12
|
artikel
|
| 7 |
Electron correlation methods based on the random phase approximation
|
Eshuis, Henk
|
|
2012
|
131 |
1 |
p. 1-18
|
artikel
|
| 8 |
Electronically excited states and photodynamics: a continuing challenge
|
Plasser, Felix
|
|
2012
|
131 |
1 |
p. 1-14
|
artikel
|
| 9 |
Electronic structure theory: present and future challenges
|
Hirata, So
|
|
2012
|
131 |
1 |
p. 1-4
|
artikel
|
| 10 |
Exact decoupling of the relativistic Fock operator
|
Peng, Daoling
|
|
2011
|
131 |
1 |
p. 1-20
|
artikel
|
| 11 |
Explicitly correlated wave functions: summary and perspective
|
Ten-no, Seiichiro
|
|
2012
|
131 |
1 |
p. 1-11
|
artikel
|
| 12 |
Fifty years of TCA
|
Cramer, Christopher J.
|
|
2012
|
131 |
1 |
p. 1-6
|
artikel
|
| 13 |
Fully relativistic theories and methods for NMR parameters
|
Xiao, Yunlong
|
|
2012
|
131 |
1 |
p. 1-17
|
artikel
|
| 14 |
Nanoparticle morphology and aspect ratio effects in Ag/PVDF nanocomposites
|
Rowan, Christopher K.
|
|
2012
|
131 |
1 |
p. 1-11
|
artikel
|
| 15 |
Negative energy states in relativistic quantum chemistry
|
Wüllen, Christoph van
|
|
2012
|
131 |
1 |
p. 1-6
|
artikel
|
| 16 |
Theoretical characterization of reaction dynamics in the gas phase and at interfaces
|
Guo, Hua
|
|
2012
|
131 |
1 |
p. 1-3
|
artikel
|
| 17 |
Theoretical chemistry: current applications to photochemistry and thermochemistry
|
Ornellas, Fernando R.
|
|
2012
|
131 |
1 |
p. 1-3
|
artikel
|
| 18 |
Time-dependent wave packet propagation using quantum hydrodynamics
|
Kendrick, Brian K.
|
|
2012
|
131 |
1 |
p. 1-19
|
artikel
|
| 19 |
Toward ab initio refinement of protein X-ray crystal structures: interpreting and correlating structural fluctuations
|
Falklöf, Olle
|
|
2012
|
131 |
1 |
p. 1-16
|
artikel
|
| 20 |
Uniform electron gases
|
Gill, Peter M. W.
|
|
2011
|
131 |
1 |
p. 1-9
|
artikel
|
| 21 |
Uniform electron gases
|
Gill, Peter M. W.
|
|
2012
|
131 |
1 |
p. 1-9
|
artikel
|
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