nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
A putative mechanism for capture of carbon dioxide by quartz, mediated by triboelectric charging
|
Knak Jensen, Svend J. |
|
|
816 |
C |
p. |
artikel |
2 |
Contents continued
|
|
|
|
816 |
C |
p. |
artikel |
3 |
Corrigendum to “Raman spectroscopic, computational, and X-ray crystallographic investigation of intermolecular interactions in trimethylamine N-oxide (TMAO) and TMAO-d9” [Chem. Phys. Lett. 805 (2022) 139928]
|
McNamara, Louis E. |
|
|
816 |
C |
p. |
artikel |
4 |
Editorial Board
|
|
|
|
816 |
C |
p. |
artikel |
5 |
Effect of confinement on the structure, stability and aromaticity of Be3 2 −
|
Jha, Ruchi |
|
|
816 |
C |
p. |
artikel |
6 |
Ehrenfest dynamics with quantum mechanical nuclei
|
Tully, John C. |
|
|
816 |
C |
p. |
artikel |
7 |
Excited-state molecular dynamics simulation based on variational quantum algorithms
|
Hirai, Hirotoshi |
|
|
816 |
C |
p. |
artikel |
8 |
Graphical abstract TOC
|
|
|
|
816 |
C |
p. |
artikel |
9 |
Graphical abstract TOC
|
|
|
|
816 |
C |
p. |
artikel |
10 |
Highly hydrophilic acrylate copolymer supported MIL-160 for air water harvesting
|
Li, Tieyan |
|
|
816 |
C |
p. |
artikel |
11 |
Modelling shear thinning of Imidazolium-based ionic liquids
|
Yamada, Tatsuya |
|
|
816 |
C |
p. |
artikel |
12 |
Molecular dynamics simulation of ion dynamics within PEM Fuel Cells
|
Awulachew, S.S. |
|
|
816 |
C |
p. |
artikel |
13 |
Non-trivial topological crossover in functionalized AlBi monolayer
|
Sanjeev, |
|
|
816 |
C |
p. |
artikel |
14 |
Re12C80: A pentagonal hexecontahedron molecule
|
Ai, Ling-Yan |
|
|
816 |
C |
p. |
artikel |
15 |
Solid-liquid phase equilibrium for the hexamethylenetetramine–NH4Cl–H2O system: Solubility determination, model correlation and molecular simulation
|
Qiao, Kang |
|
|
816 |
C |
p. |
artikel |
16 |
Theoretical prediction of the influence of defects and atomic occupation on the elastic and electronic properties of NbSi2 form the first-principles calculations
|
Feng, Quan |
|
|
816 |
C |
p. |
artikel |
17 |
Theoretical study on the gas phase hydroxyl radical reaction with tetrahydrothiophene, tetrahydrofuran, thiophene and furan
|
Upadhyaya, Hari P. |
|
|
816 |
C |
p. |
artikel |
18 |
The virial theorem with periodic boundary conditions
|
Maggs, A.C. |
|
|
816 |
C |
p. |
artikel |
19 |
Time-dependent Hartree–Fock–Bogoliubov method for molecular systems: An alternative excited-state methodology including static electron correlation
|
Nishida, Masatsugu |
|
|
816 |
C |
p. |
artikel |