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                             19 gevonden resultaten
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.

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2 Contents continued
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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.

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4 Editorial Board
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5 Effect of confinement on the structure, stability and aromaticity of Be3 2 − Jha, Ruchi

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6 Ehrenfest dynamics with quantum mechanical nuclei Tully, John C.

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7 Excited-state molecular dynamics simulation based on variational quantum algorithms Hirai, Hirotoshi

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8 Graphical abstract TOC
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9 Graphical abstract TOC
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10 Highly hydrophilic acrylate copolymer supported MIL-160 for air water harvesting Li, Tieyan

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11 Modelling shear thinning of Imidazolium-based ionic liquids Yamada, Tatsuya

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12 Molecular dynamics simulation of ion dynamics within PEM Fuel Cells Awulachew, S.S.

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13 Non-trivial topological crossover in functionalized AlBi monolayer Sanjeev,

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14 Re12C80: A pentagonal hexecontahedron molecule Ai, Ling-Yan

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15 Solid-liquid phase equilibrium for the hexamethylenetetramine–NH4Cl–H2O system: Solubility determination, model correlation and molecular simulation Qiao, Kang

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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

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17 Theoretical study on the gas phase hydroxyl radical reaction with tetrahydrothiophene, tetrahydrofuran, thiophene and furan Upadhyaya, Hari P.

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18 The virial theorem with periodic boundary conditions Maggs, A.C.

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19 Time-dependent Hartree–Fock–Bogoliubov method for molecular systems: An alternative excited-state methodology including static electron correlation Nishida, Masatsugu

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                             19 gevonden resultaten
 
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