@NickWoods1
github

NickWoods1

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  • Stars
    star
    26
  • Global Rank 542,735 (Top 19 %)
  • Followers 11
  • Following 5
  • Registered almost 7 years ago
  • Most used languages
    Python
         75.0 %
    Fortran
         12.5 %
    Mathematica     12.5 %
  • Location πŸ‡¬πŸ‡§ United Kingdom
  • Country Total Rank 19,987
  • Country Ranking
    Mathematica     109
    Fortran
         218
    Python
         6,061

Top repositories

1

scf-xn-testsuite

Set of Kohn-Sham DFT inputs (CASTEP format) for which the SCF iterations are difficult to converge
12
star
2

density2potential

Find the Kohn-Sham potential that generates a given reference (exact) density
Python
3
star
3

cask

Computes the Kohn-Sham total energy for an input X = { Positions, Species, XC } using ultrasoft pseudopotentials and a plane-wave basis set.
Python
3
star
4

cask1d

Quantum Chemistry in 1D
Python
2
star
5

runscf

Python scripts to run CASTEP on a set of input systems (via slurm) and collect convergence data.
Python
2
star
6

cellular-automata

One-dimensional cellular automata
Python
1
star
7

curvilinear-coordinates

Notebook for visualising custom curvilinear coordinate systems
Mathematica
1
star
8

hexagon

Tight-binding and Hubbard model to investigate electronic properties of graphene and graphene-derived nanostructures.
Fortran
1
star
9

pcask1d

Periodic quantum chemistry in 1D with a plane-wave basis set
Python
1
star