supporting_information_16_N_additions_final.pdf
From the dataset abstract
Cartesian coordinates and calculated energies for all species involved in the QM calculations of Figures 2, 6 and 8, and a sample structure for the full QM/MM system in Tinker MM format.
Source: Reactions of N and O containing species on a C(100):H 2x1 reconstructed diamond surface
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Additional Information
Field | Value |
---|---|
Data last updated | June 5, 2017 |
Metadata last updated | June 5, 2017 |
Created | June 5, 2017 |
Format | application/pdf |
License | Non-Commercial Government Licence for public sector information |
created | over 6 years ago |
format | |
id | 7346673b-5fc0-49d4-8b0b-2dbb22ce0819 |
mimetype | application/pdf |
on same domain | True |
package id | e009a4d3-1a5f-4afe-b847-d6c6fd15f4f3 |
resource group id | 66b6ae9c-96f1-44be-bc19-16abba0ae7ba |
revision id | 15e0c545-5d57-4cb8-bd62-9c39555a7d48 |
size | 224.8 KiB |
state | active |
type | file |
webstore last updated | None |
webstore url | None |