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leopold.talirz

Zurich, Switzerland

Interests: Physics, electronic structure simulations

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17
Is there a database where we can find previously determined geometries of materials?
mattermodeling.stackexchange.com

15
Using Pylint in Ipython (Jupyter-Notebook)
stackoverflow.com

14
What are the freely available crystal-structure visualization softwares?
mattermodeling.stackexchange.com

13
Easy ways to generate "teaching" band structures in Python?
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10
Which schedulers are compatible with a virtual machine?
mattermodeling.stackexchange.com

9
Software for Molecular Dynamics in Material Science
mattermodeling.stackexchange.com

8
Non-constant Vacuum potential
mattermodeling.stackexchange.com

8
Why volume of unit cell is not the same as cubing the lattice constant?
mattermodeling.stackexchange.com

8
Why is the planewave codes ecosystem healthier on free/opensource software adoption, when compared to codes supporting atom-centered orbitals?
mattermodeling.stackexchange.com

8
When to use pseudohydrogens to passivate a slab?
mattermodeling.stackexchange.com

7
How do I compile Quantum Espresso with HDF5 support? (Linux)
mattermodeling.stackexchange.com

7
Methods to determine the vacuum level in 2D compounds in the presence of dipoles
mattermodeling.stackexchange.com

6
How do you see file permissions in Github?
stackoverflow.com

6
Has DFT helped in development of better solar materials?
mattermodeling.stackexchange.com

6
Tools for high-throughput DFT studies?
mattermodeling.stackexchange.com

6
Binding energy calculation for Zn atom on armchair graphene slab?
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6
Is there a free package with robust CASSCF functionality?
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6
How to numerically solve real-space 1D time-independent Schrodinger equation using 2D momentum-space Hamiltonian?
mattermodeling.stackexchange.com

5
Becoming non root user in ansible fails
stackoverflow.com

5
How to run 2nd generation CPMD in CP2K?
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