New answers tagged condensed-matter
0
votes
How to read UPF pseudopotential for ultrasoft pseudopotential simple in a fortran program
For now, the UPF standard is defined on Quantum ESPRESSO's website. Looks like the documentation is for an XML-like format, but it will be (or has already been, ...
0
votes
Where/when did the fields of Operations Research and Spin Physics or Molecular Dynamics begin to cross-pollinate?
The cross-pollination and exchange of ideas between the operations research and physics communities in the context of Ising optimization methods can be traced back to several key papers and ...
Top 50 recent answers are included
Related Tags
condensed-matter × 119density-functional-theory × 41
model-hamiltonians × 21
solid-state-physics × 18
quantum-mechanics × 16
band-structure × 14
berry-phase × 13
topological-insulators × 12
vasp × 11
quantum-espresso × 11
symmetry × 10
physical-properties-of-materials × 9
quantum-chemistry × 8
mathematical-modeling × 7
graphene × 6
software × 5
reference-request × 5
electronic-structure × 5
tight-binding × 5
one-topic-per-answer × 4
ab-initio-calculations × 4
computational-chemistry × 4
python × 4
high-performance-computing × 4
magnetism × 4