Molecular Physics Adsorption performance of TM doped (TM = Fe, Ni, Cr and Zn) silicon carbide nanotubes towards formaldehyde: a DFT-M06-L study. By Hossein Roohi, 3 years ago
Molecular Physics Comparative study of external electric field and potential effects on liquid water ions. By Satyanarayana Bonakala, 3 years ago
Molecular Physics Controlled preparation and vibrational excitation of single ultracold molecular hydrogen ions. By Christian Wellers, 3 years ago
Molecular Physics Computational mechanistic insights into hafnium catalyzed CO2 activation and reduction. By Jenbrie M. Kessete, 3 years ago
Molecular Physics Fine tuning of hydrogen bond strength in crystals: a case study of O–H–O hydrogen bond in ammonium substituted potassium dihydrogen phosphate. By R. R. Choudhury, 3 years ago
Molecular Physics Effect of iridium doping on electronic structure and optical properties of m-BiVO4 photocatalytic materials: a first principles study. By Jianbo Liu, 3 years ago
Molecular Physics Equivalence between Wolf and Yukawa non-homogeneous fluids in a gravitational field. By X. Sánchez-Monroy, 3 years ago
Molecular Physics The 5.8 µm absorption bands for nitric acid (H14N16O3): line positions and intensities for the ν2 band at 1709.567 cm−1 and for its first associated hot bands (ν2+ν9−ν9, ν2+ν7−ν7, ν2+ν6−ν6). By A. Perrin, 3 years ago
Molecular Physics On the virial expansion of model adsorptive systems. By William P. Krekelberg, 3 years ago