Published January 16, 2023
| Version v1
Dataset
Open
Diffusion jump structures for H, N and O atoms
Description
Structures of minima and TSs or directly entire minimum energy paths for diffusion jumps of H, N and O atoms on water clusters.
Files
Diffusion_structures.zip
Files
(138.6 kB)
| Name | Size | Download all |
|---|---|---|
|
md5:1cf94490280311d8c4c6e209ba157b08
|
138.6 kB | Preview Download |