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Ammonia as a case study for the spontaneous ionization of a simple hydrogen-bonded compound

Nature Communications · 2014 · Vol. 5(1) · pp. 3460–3460
Taras PalasyukI. A. TroyanM. I. EremetsVadym DrozdSergey A. MedvedevPatryk Zaleski‐EjgierdEwelina Magos–PalasyukHongbo WangStanimir BonevDmytro DudenkoPavel G. Naumov
Advanced Chemical Physics StudiesQuantum, superfluid, helium dynamicsSpectroscopy and Quantum Chemical StudiesIonic bondingChemical physicsAutoionizationAb initioHydrogen bondChemistryMolecular dynamicsAmmoniaHydrogenComputational chemistry

Funding

  • U.S. Department of Energy
  • Deutsche Forschungsgemeinschaft
  • Fundacja na rzecz Nauki Polskiej
  • Lawrence Livermore National Laboratory
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