[Wannier] memory usage increase with iteration of wannierising

[Giovanni Pizzi]

And I guess that both have the same behavior, i.e. seem to give a memory leak in your case?

Giovanni


--
Giovanni Pizzi
Post-doctoral Research Scientist
EPFL STI IMX THEOS
MXC 340 (Bâtiment MXC)
Station 12
CH-1015 Lausanne (Switzerland)
Phone: +41 21 69 31124




On 22 Jun 2013, at 00:23, Haowei Peng wrote:

Hi Giovanni,

I tried both versions.

haowei


On Fri, Jun 21, 2013 at 4:20 PM, Giovanni Pizzi <giovanni.pizzi at epfl.ch<mailto:giovanni.pizzi at epfl.ch>> wrote:
Hi Haowei,
just a quick question: are you using v. 1.2 or the version I sent you?

Giovanni

--
Giovanni Pizzi
Post-doctoral Research Scientist
EPFL STI IMX THEOS
MXC 340 (Bâtiment MXC)
Station 12
CH-1015 Lausanne (Switzerland)
Phone: +41 21 69 31124<tel:%2B41%2021%2069%2031124>




On 21 Jun 2013, at 22:59, Haowei Peng wrote:

Hello,

I found that the memory usage increases with the iteration of wannierising.
I already tried the keywork "optimisation = 0", which does not help.
If the num_iter is quite large and convergence is not good, this will lead to crash in the end.
Can this be avoided?

Thanks a lot,

--
Haowei Peng

National Renewable Energy Laboratory
15013 Denver West Pkwy
Golden, CO 80401
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--
Haowei Peng

National Renewable Energy Laboratory
15013 Denver West Pkwy
Golden, CO 80401
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