20 results on '"Kuo, Jer-Lai"'
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2. Structural and vibrational characterization of HCO+ and Rg–HCO+, Rg = {He, Ne, Ar, Kr, and Xe}
3. Fermi resonance switching in KrH+Rg and XeH+Rg (Rg = Ne, Ar, Kr, and Xe)
4. Vibrational spectroscopic signatures of hydrogen bond induced NH stretch–bend Fermi-resonance in amines: The methylamine clusters and other N–H⋯N hydrogen-bonded complexes
5. A theoretical study on the infrared signatures of proton-bound rare gas dimers (Rg–H+–Rg), Rg = {Ne, Ar, Kr, and Xe}
6. Infrared spectra of neutral dimethylamine clusters: An infrared-vacuum ultraviolet spectroscopic and anharmonic vibrational calculation study
7. Polar ordering and structural distortion in electronic domain-wall properties of BiFeO3
8. First-principles study of band gap engineering of ZnO by alloying with LiGaO2 for ultraviolet applications
9. First principles molecular dynamics study of filled ice hydrogen hydrate
10. Calculation of near K edge x-ray absorption spectra and hydrogen bond network in ice XIII under compression
11. Structure and vibrational spectra of H+(HF)n (n=2–9) clusters: An ab initio study
12. Infrared photodissociation spectroscopy and density-functional calculations of protonated methanol cluster ions: Solvation structures of an excess proton
13. A direct first principles study on the structure and electronic properties of BexZn1−xO
14. Compatibility between methanol and water in the three-dimensional cage formation of large-sized protonated methanol-water mixed clusters
15. The effect of proton disorder on the structure of ice-Ih: A theoretical study
16. Protonated clathrate cages enclosing neutral water molecules: H+(H2O)21 and H+(H2O)28
17. Structure of protonated water clusters: Low-energy structures and finite temperature behavior
18. Dissociation of hydrogen fluoride in HF(H2O)7
19. Short H-bonds and spontaneous self-dissociation in (H2O)20: Effects of H-bond topology
20. On the use of graph invariants for efficiently generating hydrogen bond topologies and predicting physical properties of water clusters and ice
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