Structural Evidence of Interanionic Hydrogen Bonding in Phosphoric Acid Solutions

Structural Evidence of Interanionic Hydrogen Bonding in Phosphoric Acid Solutions

Interanionic hydrogen bonding (IAHB) is a noncovalent interaction between like-charged ions that challenges conventional electrostatic understanding. This study provides direct structural evidence of IAHB in concentrated aqueous phosphoric acid (PA) solutions, which exhibit >60% dissociation unde...

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Príomhchruthaitheoir: Pyeongeun Kim (9509954) (author)
Rannpháirtithe: Richard Kang (12097082) (author), Kevin Carter-Fenk (6690314) (author), Kevin R. Wilson (1235583) (author), Martin Head-Gordon (588951) (author), Musahid Ahmed (1282341) (author)
Foilsithe / Cruthaithe: 2025
Ábhair:
Biophysics
Biochemistry
Cancer
Computational Biology
Astronomical and Space Sciences not elsewhere classified
Chemical Sciences not elsewhere classified
Physical Sciences not elsewhere classified
two fragments driven
range ordering consistent
interanionic hydrogen bonding
energy decomposition analysis
electron affinity time
surrounding solvent molecules
phosphate iahb dimers
cyclic phosphate
structural evidence
phase iahb
permanent electrostatics
oxygen k
noncovalent interaction
extended x
energetically favored
edge x
dimeric species
dependent transition
critical role
charged ions
charge transfer
bonded networks
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