Abinitio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

The Journal of chemical physics, 1995 - pubs.aip.org
Charge defects in water created by excess or missing protons appear in the form of solvated
hydronium H3O+ and hydroxyl OH− ions. Using the method of ab initio molecular dynamics …

Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - The Journal of …, 1995 - research.ibm.com
Charge defects in water created by excess or missing protons appear in the form of solvated
hydronium H3O+ and hydroxyl OH-ions. Using the method of ab initio molecular dynamics …

Abinitio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - The Journal of Chemical …, 1995 - cir.nii.ac.jp
抄録< jats: p> Charge defects in water created by excess or missing protons appear in the
form of solvated hydronium H3O+ and hydroxyl OH− ions. Using the method of ab initio …

Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - The Journal of …, 1995 - nyuscholars.nyu.edu
Charge defects in water created by excess or missing protons appear in the form of solvated
hydronium H 3 O+ and hydroxyl OH-ions. Using the method of ab initio molecular dynamics …

Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - Journal of Chemical …, 1995 - research.aalto.fi
Charge defects in water created by excess or missing protons appear in the form of solvated
hydronium H 3 O+ and hydroxyl OH-ions. Using the method of ab initio molecular dynamics …

Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - The Journal of Chemical …, 1995 - pubs.aip.org
Understanding the behavior of ions in water is essential if one wishes to gain insight into
many processes in chemistry and biology. The numerous subtleties surrounding structural …

Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water

M Tuckerman, K Laasonen, M Sprik… - Journal of Chemical …, 1995 - ui.adsabs.harvard.edu
Charge defects in water created by excess or missing protons appear in the form of solvated
hydronium H 3 O+ and hydroxyl OH-ions. Using the method of ab initio molecular dynamics …

[引用][C] AB INITIO MOLECULAR DYNAMICS SIMULATION OF THE SOLVATION AND TRANSPORT OF HYDRONIUM AND HYDROXYL IONS IN WATER

M TUCKERMAN, K LAASONEN… - The Journal of …, 1995 - American Institute of Physics