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@pabitra.83
@pabitra.83 13 күн бұрын
Is it compatible to siesta 4.1-b4?
@brendanpaget2914
@brendanpaget2914 19 күн бұрын
How do I get the script for this?
@Deep_science_sorts
@Deep_science_sorts Ай бұрын
Scripts; github.com/shambhuphysics
@SAJALPHYS
@SAJALPHYS Ай бұрын
Thank you sir. How we the viewers and subscribers can access the scripts. With thanks and regards
@harshavermaph.d.student2147
@harshavermaph.d.student2147 Ай бұрын
Very productive tutorials, Could you please provide the mechanical properties calculation script.
@mikhailfrolov8903
@mikhailfrolov8903 2 ай бұрын
Great video! Can you send this script to me?
@rabiafarooq4815
@rabiafarooq4815 3 ай бұрын
nice bro but why don't you showed 2.job.sh file :(
@Promotionoutlet
@Promotionoutlet 3 ай бұрын
Great work 💯
@AliZulfiqar-im9zm
@AliZulfiqar-im9zm 5 ай бұрын
Can you run NVE MD simulation by siesta and show how to analysis it's output file.
@yisehakg5039
@yisehakg5039 5 ай бұрын
Thank you 🙏 so much for your kind sharing!!!
@zakairyan1255
@zakairyan1255 5 ай бұрын
Thank you for video, your explanation style is very good.Please make video for molecular dynamic calculation for beginners.
@wnd_rdr
@wnd_rdr 5 ай бұрын
i love penta-BCN :D
@FIFA_ICC
@FIFA_ICC 5 ай бұрын
Nice
@Wildlonesome77
@Wildlonesome77 5 ай бұрын
We take for granted our beautiful planet.
@wishabc6465
@wishabc6465 5 ай бұрын
File "/usr/lib/python3/dist-packages/phonopy/harmonic/force_constants.py", line 842, in _get_sym_mappings_from_permutations raise ValueError(text) ValueError: Input forces are not enough to calculate force constants,or something wrong (e.g. crystal structure does not match). I am facing this error when applying phonopy -p -s band.conf in vasp
@faradaymahe
@faradaymahe 5 ай бұрын
Could you make a video regarding electrode calculation.
@anila5561
@anila5561 6 ай бұрын
How to calculate the mechanical properties with strain effect in vasp
@elephantgogogo6981
@elephantgogogo6981 6 ай бұрын
Hi, could you please tell me, why in my band plot, I have only phonon spectrum and I don't have the DOS on the right side
@NaveedAshraf-yo6ox
@NaveedAshraf-yo6ox 7 ай бұрын
Sir how to install ovito in VASP?
@dhararaval
@dhararaval 7 ай бұрын
Please show NEB calculations using PASTA code with SIESTA, if possible
@dhararaval
@dhararaval 7 ай бұрын
is it work in the siesta 4.0 ?
@farahshehzadi6355
@farahshehzadi6355 7 ай бұрын
How can to create band.conf ?
@jawadhussain3372
@jawadhussain3372 7 ай бұрын
just creat a file name band.conf and write the required tags(DIMs, BandPoints, BandLabels) for phonon band structure, use the phonopy command and get the results
@farahshehzadi6355
@farahshehzadi6355 7 ай бұрын
@@jawadhussain3372 ok do you know important tags in vasp in order to converge structure to stability while calculating phonon calculations?
@jawadhussain3372
@jawadhussain3372 7 ай бұрын
I am not getting your point, important tags of INCAR or band.conf. In case of dynamic stability, you need only 4 tags in band.conf to check imaginary phonons for stability and this is post process @@farahshehzadi6355
@muneebulhassan7832
@muneebulhassan7832 8 ай бұрын
It's great, can we do the similar with windows PCs too?
@himalaykolavada
@himalaykolavada 9 ай бұрын
link of github is not working. will you please provide it again?
@Deep_science_sorts
@Deep_science_sorts Ай бұрын
github.com/shambhuphysics
@anila5561
@anila5561 9 ай бұрын
Please make a video on thermal correction using vasp
@utsavprajapati4943
@utsavprajapati4943 9 ай бұрын
does it work for siesta 4.0 ?
@Deep_science_sorts
@Deep_science_sorts 9 ай бұрын
I think, yes !
@NaveedAshraf-yo6ox
@NaveedAshraf-yo6ox 9 ай бұрын
Hi i usually follow your vides and i have need help to run the calculation for phonon
@anila5561
@anila5561 9 ай бұрын
In my MD graph the energy is changed after 2500 fs how to determine the bond length of structure to find that there is any phase transition
@anila5561
@anila5561 9 ай бұрын
How to calculate the bond length with time steps after MD simulations.
@Deep_science_sorts
@Deep_science_sorts 9 ай бұрын
Find radial distribution function, the first max peak on that plot gives you the bond length. Or Extract POSCAR from the XDAtcar file at each step and measure it from vESTa.
@Brad4Ellis
@Brad4Ellis 9 ай бұрын
It’s not FYE-bonacci. It’s Italian. Soft “i.” It’s a fascinating area of mathematics, but if you don’t know how to pronounce it, you’ve never actually discussed it with anyone, so you can’t have much of a grasp of it. Sheesh. Especially a computer voice should get this right! Fibonacci (/ˌfɪbəˈnɑːtʃi/
@ChristopherAnders-dd4hd
@ChristopherAnders-dd4hd 9 ай бұрын
Yes he is
@donb7113
@donb7113 9 ай бұрын
God used science and math to create His Kingdom.
@FIFA_ICC
@FIFA_ICC 9 ай бұрын
Genius
@therealmagmalord3479
@therealmagmalord3479 9 ай бұрын
Ok, i already believe in god, but looking for ways to convince people of god, like this one, makes it sound stupid, which could actually deter more people. If you wont listento their stupid theories, they probably wont listen to yours. People need their own reason to switch beliefs, its kind of similar to quality over quantity.
@AranthusGaming
@AranthusGaming 9 ай бұрын
"The laws of nature are but the mathematical thoughts of God"- Euclid
@QnA22
@QnA22 9 ай бұрын
It proved something, but it definitely doesn't prove there is a God(s). If you had done that, then I would be convinced. So, I'm not sure why you chose this alternative.
@cirqueyeagerist5641
@cirqueyeagerist5641 9 ай бұрын
What i think is god made it with his own way ( god here dosent means a physical human , god is infinite , omnipotent and perfect ) we humans understood it in this way , we interpreted this nature with maths maybe if a alien comes in he must have another language . Its our understanding of the nature we call math
@onushrichawhan1414
@onushrichawhan1414 9 ай бұрын
Not convencied
@-Xx_Bossman_xX-
@-Xx_Bossman_xX- 9 ай бұрын
You are my new science tescher im subbing im waiting for more content
@RADICALFLOAT95
@RADICALFLOAT95 9 ай бұрын
This video is actually genuinely underated
@user-zv4hl3xd8b
@user-zv4hl3xd8b 9 ай бұрын
You earn thyself a sub
@tbone1759
@tbone1759 9 ай бұрын
THEORY , , NOT LAW
@Deep_science_sorts
@Deep_science_sorts 9 ай бұрын
Based on the BBC article: www.bbc.co.uk/news/science-environment-48369980
@DaNyAaLcEc
@DaNyAaLcEc 9 ай бұрын
Its quite clear the pyramids were just extensions of the pharoahs' penis and nothing more and had nothing to do with the advanced spiritualities of the ancient egyptians and their priestly classes
@juanairielsanchezortiz9280
@juanairielsanchezortiz9280 9 ай бұрын
Thomas A. Edison stolen almost all his discover.😢😢😢
@eyhab3766
@eyhab3766 9 ай бұрын
Pls do not solve it wait me to finish my school years and do whatever u want
@abdullahbham4271
@abdullahbham4271 9 ай бұрын
Look we exist in an information driven system .. a simulated reality .. nothing has an independent reality .. the physics Nobel prize went to zeilinger and two others who prove entanglement and the observer effect to be facts .. God is the driver in earth in heaven and in the hell fire .
@abdullahbham4271
@abdullahbham4271 9 ай бұрын
Massive contradiction .. life thrives from simple to complex in a place which is going from order to chaos ?
@PsiRipples
@PsiRipples 9 ай бұрын
Yes I think the words don't help the theory. I kinda view it that low entropy is lots of 'useful' energy and it moves to 'useless' energy. Life does this in a comparatively efficient way hence its existence. However life on earth is getting constantly bombarded with 'useful' energy from the sun hence life being reborn and becoming more complex because the more complex life is the more efficient it becomes.
@DFTify
@DFTify 9 ай бұрын
Thank You for a most awaited tutorial video on SIESTA. Can 8 core system with 32GB RAM handle such calculation?
@Deep_science_sorts
@Deep_science_sorts 9 ай бұрын
8 core -32 GB RAM is a strong machine for SIESTA - it should work! Could you give it a try, and let me know how good values you got?
@user-hananab
@user-hananab 9 ай бұрын
Thankfully , can you please show how to run the spin orbit calculation, and plot the result with jupyter notebook?
@Deep_science_sorts
@Deep_science_sorts 9 ай бұрын
sure