There will be some strain at the monolayer/substrate interface which you
have to energetically minimize.
Regards,
Aaron
On 14/03/16 09:37, pooja pu wrote:
i'll create vaccum...but how to put a monolayer on the substrate???????
On Mon, Mar 14, 2016 at 2:52 PM, Максим Арсентьев
<[email protected] <mailto:[email protected]>> wrote:
add vacuum layer upwand the monolayer and substrate, so you can
get this calc
2016-03-14 11:25 GMT+04:00 pooja pu <[email protected]
<mailto:[email protected]>>:
hello gud people,
with regards
To all siesta users noble metal monolayers are not stable in
free standing but are stable with substrates,.....
so, my querry is that how can we do monolayer with substrate
calculation....how to simulate this system....
plz send if any example file...
Thanks for all helps
pooja
--
Best wishes,
Maxim Arsent'ev, Ph.D. (Chemistry)
Laboratory of research of nanostructures
Institute of Silicate Chemistry of RAS
--
PhD student
B321/28
Aaron Thong
