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The chemical shift of deprotonated water dimer: ab initio path integral simulation

Motoyuki Shiga1, Kimichi Suzuki, Masanori Tachikawa

  • 1CCSE, Japan Atomic Energy Agency, Higashi-Ueno 6-9-3, Taito-ku, Tokyo 110-0015, Japan. shiga.motoyuki@jaea.go.jp

The Journal of Chemical Physics
|March 25, 2010
PubMed

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