Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

[2PC-171] Theoretical analysis of H/D isotope effect on the positron binding to acetaldehyde molecule

03.Poster

○DOHI, Kaito; TACHIKAWA, Masanori; KITA, Yukiumi (International Coll. Arts Sci., Yokohama City Univ.)

Keywords:positron、acetaldehyde、H/D isotope effect、vibrational Quantum Monte Carlo method