Many thanks for your tutorials. I am curious to know what are the computer requirements for "Quantum Espresso". Is it possible to perform all sort of calculations with normal laptops or PC? For instance, if we wanted to perform a GGA:PBE for 512 atoms, is it performable with a laptop?
@theafrod85803 жыл бұрын
This operation is not so user friendly. Sir can you please tell , why are we doing these operations , whats the aim of this experiment
@pratiksarkar35513 жыл бұрын
sir you told that u shall discuss about the optimization etc in upcoming videos. But no videos are there related to q.s( except these two videos) in your channel, plz answer sir
@orlandocastroocampo46183 жыл бұрын
Can run QE-GPU in Windows ? and How could install it?
@@samirmeher2000 How to get BURAI software shortcut on desktop?
@drswarnashriya87543 жыл бұрын
mpi file download nahin karna hai
@happyworld18493 жыл бұрын
Is Burai mandatory for QE calculations on Windows?
@shayyavioiss67703 жыл бұрын
Part 2 on how to run? Thanks! This was super hepful
@vigneshmurugadoss14613 жыл бұрын
Please help to solve this error "Could not open file C:\Users\vigne\.burai\.pseudopot\Ti.pbesol-spn-kjpaw_psl.1.0.0.UPF - not a valid URI"
@torukazama63783 жыл бұрын
try to download the pseudo potential file q-e site
@sunil_bhagtani3 жыл бұрын
@@torukazama6378 Sahi bola
@hennamalakar23803 жыл бұрын
I have the same problem. Where to save those pseudo files?
@granophyre93603 жыл бұрын
I solved this by changing backslash (\) to forward slash (/) in the pseudopotential directory location on line 4 of the zns.scf input file (e.g. "C:/Users/vigne/.burai/.pseudopot" might work in the above case).
@lynx10293 жыл бұрын
Hi. Thanks for the video. Does it work for AMD processor?
@sipundash3 жыл бұрын
is it efficient or going to linux better choice?
@samirmeher20003 жыл бұрын
It is efficient. But linux is always a better choice for any kind of numerical calculations.
@priyankaroy68044 жыл бұрын
When is QE-3 video coming sir? Waiting. Please also explain how to calculate Dos, bandgap in quantum espresso. Thank you so much making such videos
@samirmeher20004 жыл бұрын
By next 7 days
@narayananick48723 жыл бұрын
@@samirmeher2000 Sir, have you uploaded the QE-3 video on a different channel sir?
@alicanguler47614 жыл бұрын
Thank you, professor. in my opinion, the series of videos is the best explanatory and updated in its class.
@samirmeher20004 жыл бұрын
Thank you
@abiavi95184 жыл бұрын
Thank you sir
@himanshusekharmishra75034 жыл бұрын
One of the best lecture
@himanshusekharmishra75034 жыл бұрын
Sir urs teaching is fantastic
@aasthatiwati49216 жыл бұрын
its not a cluisster expapansion i want this😭
@sagarrawal83326 жыл бұрын
Brillantly explained...Sir I was looking at One dimensional harmonics Oscillator and I was confuse at the red mark part where the volume is given but then the volume disappears and when using the formula for volume for phase space .In case of 3N dimension we write (pi) 3N/2 and but Here since it is one dimension there must be only power on (pi)^N but instead here it uses (pi)^2N/2 could you please explain me how does 2 factor comes and where does volume disappears..Link is here ibb.co/e0WEW8
@imranapari68016 жыл бұрын
Ok I will b waiting for that sir
@imranapari68016 жыл бұрын
Sir can I get explanation of ideal in canonical ensemble
@samirmeher20006 жыл бұрын
I will try to upload the ideal gas in the canonical ensemble shortly
@sagarrawal83326 жыл бұрын
can I please get this ppt file??
@aasthatiwati49216 жыл бұрын
buy its not a cluster exapansion in classical ideal gas for my presentation