publication venue for
- Procrustes: A python library to find transformations that maximize the similarity between matrices. 276:108334-108334. 2022
- WloopPHI: A tool for ab initio characterization of Weyl semimetals. 270:108147-108147. 2022
- BESLE: Boundary element software for 3D linear elasticity. 265:108009-108009. 2021
- Perturbation approach to ab initio effective mass calculations. 261:107648-107648. 2021
- Recent developments in the ABINIT software package. 205:106-131. 2016
- CheMPS2 : Improved DMRG-SCF routine and correlation functions. 191:235-237. 2015
- CheMPS2: A free open-source spin-adapted implementation of the density matrix renormalization group for ab initio quantum chemistry. 185:1501-1514. 2014
- BerryPI: A software for studying polarization of crystalline solids with WIEN2k density functional all-electron package. 184:647-651. 2013
- Finite Fourier transforms computed by a modified Filon–Euler–Maclaurin method. 184:607-616. 2013
- Variational density matrix optimization using semidefinite programming. 182:2025-2028. 2011
- Numerical studies of photon-based spectroscopies on high- superconductors. 182:106-108. 2011
- A parallel adaptive P3M code with hierarchical particle reordering. 174:540-554. 2006
- TWOGEN—a simple Monte Carlo generator for two-photon reactions. 79:523-532. 1994
- Parallel analysis of data on a multi-node VAX cluster. 67:407-411. 1992
- Coupled finite element and boundary element method in electromagnetics. 68:255-278. 1991
- NMR chemical shifts in periodic systems from first principles 2002