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Author: Manas Sharma

Ph.D. researcher at Friedrich-Schiller University Jena, Germany. I'm a physicist specializing in computational material science. I write efficient codes for simulating light-matter interactions at atomic scales. I like to develop Physics, DFT, and Machine Learning related apps and software from time to time. Can code in most of the popular languages. I like to share my knowledge in Physics and applications using this Blog and a YouTube channel.

A Place for my head(Linkin Park) intro on guitar

Guitar My lifeJun 9, 2014 Manas Sharma

Hey Guys if you are a rock/pop fan then you have definitely heard linkin park and ergo the song “A place for My…

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Avian collection

UncategorizedMar 23, 2014 Manas Sharma

Wow isn’t that just amazing … the birds are so cute ..:) Manas SharmaPh.D. researcher at Friedrich-Schiller University Jena, Germany. I’m a physicist…

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A Music Piece

Guitar My lifeMar 22, 2014 Manas Sharma

Here is a little jam session that me and my friend had a while back…. I am playing the rhythm and he is…

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Me and My Guitar(AXE)!

My lifeMar 16, 2014 Manas Sharma

Sometimes you want to give up the guitar, you’ll hate the guitar. But if you stick with it, you’re gonna be rewarded. Manas…

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Finally…

My life Web PublishingJun 19, 2013 Manas Sharma

Yes finally i have started work on my latest project. Can’t really tell you what it exactly is but you will see it…

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Hello world!

UncategorizedJan 20, 2012 Manas Sharma

Welcome to WordPress. This is your first post. Edit or delete it, then start blogging! Manas SharmaPh.D. researcher at Friedrich-Schiller University Jena, Germany.…

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Latest Articles

  • RIPER Tools for TURBOMOLE
    Sep 4, 2023
  • LK99 Structure files in CIF, POSCAR and other formats
    Aug 13, 2023
  • How to compute the kinetic energy density on grid points using PySCF? [TUTORIAL]
    Jul 17, 2023
  • How to install TURBOMOLE (Quantum Chemistry Package) on Linux? [TUTORIAL]
    Jul 14, 2023
  • How to parse (read) .XYZ atomic coordinates file using Python? [TUTORIAL]
    Jul 4, 2023
  • Poster ICQC 2023 – Efficient Simulation of High Harmonic Generation Using Gaussian Basis Functions
    Jun 21, 2023

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phys.whiz

phys.whiz
Isosurface of the spin-density of #LK99 calculated Isosurface of the spin-density of #LK99 calculated using TURBOMOLE and visualized using @crysx_3d 

The concentration on Cu and the neighbouring oxygen atoms is in accordance with literature
You don't need fancy software or codes to dive int You don't need fancy software or codes to dive into #LK99 analysis. 
Back in my master's days, I developed @crysx_3d — Android apps for crystal visualization and simulating XRD patterns among other things. 
Explore and enjoy!
#LK99 Pb9P6CuO25 #LK99
Pb9P6CuO25
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