nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
An implementation of the Levenberg–Marquardt algorithm for simultaneous-energy-gradient fitting using two-layer feed-forward neural networks
|
Nguyen-Truong, Hieu T. |
|
2015 |
629 |
C |
p. 40-45 6 p. |
artikel |
2 |
Catalysis effect of micro-hydration on the intramolecular proton transfer in cytosine
|
Valadbeigi, Younes |
|
2015 |
629 |
C |
p. 1-7 7 p. |
artikel |
3 |
Comparison of RC(O)OOH, RC(O)OOH and R(CO)OOH bond dissociation energies with RCOOH, RCOOH and RCOOH, R as phenyl, vinyl and alkyl groups
|
Sebbar, Nadia |
|
2015 |
629 |
C |
p. 102-112 11 p. |
artikel |
4 |
Contents
|
|
|
2015 |
629 |
C |
p. iii-vii nvt p. |
artikel |
5 |
Coupled cluster geometries and energies of C20 carbon cluster isomers – A new benchmark study
|
Jin, Yifan |
|
2015 |
629 |
C |
p. 76-80 5 p. |
artikel |
6 |
Editorial Board
|
|
|
2015 |
629 |
C |
p. IFC- 1 p. |
artikel |
7 |
Electronic energy gap correlation function and spectral density of anharmonic molecules at low temperatures. II: Spectroscopy
|
Toutounji, Mohamad |
|
2015 |
629 |
C |
p. 18-22 5 p. |
artikel |
8 |
Entropy production and generation: Clarity from nanosystems considerations
|
Lucia, Umberto |
|
2015 |
629 |
C |
p. 87-90 4 p. |
artikel |
9 |
Low cost, ultra-thin films of reduced graphene oxide–Ag nanoparticle hybrids as SERS based excellent dye sensors
|
Kavitha, C. |
|
2015 |
629 |
C |
p. 81-86 6 p. |
artikel |
10 |
MD simulations of He evaporating from dodecane
|
Williams, Mark A. |
|
2015 |
629 |
C |
p. 53-57 5 p. |
artikel |
11 |
Mg intercalation into Ti2C building block
|
Yu, Xue-fang |
|
2015 |
629 |
C |
p. 36-39 4 p. |
artikel |
12 |
Modeling of hydroxyapatite–peptide interaction based on fragment molecular orbital method
|
Kato, Koichiro |
|
2015 |
629 |
C |
p. 58-64 7 p. |
artikel |
13 |
Observation of two-photon induced three-photon absorption in chemically synthesized silver nanostructures
|
Biswas, S. |
|
2015 |
629 |
C |
p. 70-75 6 p. |
artikel |
14 |
Photo-initiated multi-step electron transfer in donor–acceptor systems using a novel bi-functionalized perylene chromophore
|
Dyar, Scott M. |
|
2015 |
629 |
C |
p. 23-28 6 p. |
artikel |
15 |
Pressure-induced amorphization of ionic liquid [HMIM][PF6]
|
Ren, Yufen |
|
2015 |
629 |
C |
p. 8-12 5 p. |
artikel |
16 |
Quantum dots based broad spectral photodetectors with wavelength detecting ability
|
Wang, Fei |
|
2015 |
629 |
C |
p. 13-17 5 p. |
artikel |
17 |
Single layer hydrogenated graphyne membrane for selective hydrogen separation: A molecular dynamics simulation study
|
Alaghemandi, Mohammad |
|
2015 |
629 |
C |
p. 65-69 5 p. |
artikel |
18 |
Single-molecule imaging of organic semiconductors: Toward nanoscale insights into photophysics and molecular packing
|
Shepherd, W.E.B. |
|
2015 |
629 |
C |
p. 29-35 7 p. |
artikel |
19 |
Theoretical study of the influence of cation-π and anion-π interactions on some NMR data of borazine complexes
|
Bagheri, Sotoodeh |
|
2015 |
629 |
C |
p. 46-52 7 p. |
artikel |
20 |
Thermal hydrogen-atom transfer from methane: A mechanistic exercise
|
Schwarz, Helmut |
|
2015 |
629 |
C |
p. 91-101 11 p. |
artikel |