Optimization of hyperplanar transition states: Application to 2D test problems. - Thomas Bligaard; Hannes Jónsson (Comput. Phys. Commun., 2005)

Path Optimization with Application to Tunneling. - Dóróthea M. Einarsdóttir; Andri Arnaldsson; Finnbogi Óskarsson; Hannes Jónsson (PARA (2), 2010)

Optimization of Functionals of Orthonormal Functions in the Absence of Unitary Invariance. - Peter Klüpfel; Simon Klüpfel; Kiril Tsemekhman; Hannes Jónsson (PARA (2), 2010)

Simulated Annealing with Coarse Graining and Distributed Computing. - Andreas Pedersen; Jean-Claude Berthet; Hannes Jónsson (PARA (2), 2010)

Distributed implementation of the adaptive kinetic Monte Carlo method. - Andreas Pedersen; Hannes Jónsson (Math. Comput. Simul., 2010)

Parallel implementation of gamma-point pseudopotential plane-wave DFT with exact exchange. - Eric J. Bylaska; Kiril Tsemekhman; Scott B. Baden; John H. Weare; Hannes Jónsson (J. Comput. Chem., 2011)

Efficient Sampling of Saddle Points with the Minimum-Mode Following Method. - Andreas Pedersen; Sigurdur F. Hafstein; Hannes Jónsson (SIAM J. Sci. Comput., 2011)

Geothermal model calibration using a global minimization algorithm based on finding saddle points and minima of the objective function. - Manuel Plasencia; Andreas Pedersen; Andri Arnaldsson; Jean-Claude Berthet; Hannes Jónsson (Comput. Geosci., 2014)

Computational Study of Electrochemical CO2 Reduction at Transition Metal Electrodes. - Javed Hussain; Egill Skúlason; Hannes Jónsson (ICCS, 2015)

Towards an Optimal Gradient-dependent Energy Functional of the PZ-SIC Form. - Elvar Örn Jónsson; Susi Lehtola; Hannes Jónsson (ICCS, 2015)

Method for finding mechanism and activation energy of magnetic transitions, applied to skyrmion and antivortex annihilation. - Pavel F. Bessarab; Valery M. Uzdin; Hannes Jónsson (Comput. Phys. Commun., 2015)

Global transition path search for dislocation formation in Ge on Si(001). - Emile Maras; Oleg Trushin; Alexander Stukowski; Tapio Ala-Nissila; Hannes Jónsson (Comput. Phys. Commun., 2016)

Direct energy minimization based on exponential transformation in density functional calculations of finite and extended systems. - Aleksei V. Ivanov; Elvar Örn Jónsson; Tejs Vegge; Hannes Jónsson (Comput. Phys. Commun., 2021)

Fast and robust algorithm for energy minimization of spin systems applied in an analysis of high temperature spin configurations in terms of skyrmion density. - Aleksei V. Ivanov; Valery M. Uzdin; Hannes Jónsson (Comput. Phys. Commun., 2021)

Saddle Point Search Algorithms for Variational Density Functional Calculations of Excited Electronic States with Self-Interaction Correction. - Yorick Leonard Adrian Schmerwitz; Núria Urgell Ollé; Gianluca Levi; Hannes Jónsson (PASC, 2024)

Factors influencing the adoption of awareness-raising activities in SMEs. - Erik Bergström; Joakim Kävrestad; Johannes Hou Gustafsson; Hannes Jónsson (STPIS, 2024)

Efficient Implementation of Gaussian Process Regression Accelerated Saddle Point Searches with Application to Molecular Reactions. - Rohit Goswami; Maxim V. Masterov; Satish Kamath; Alejandro Peña-Torres; Hannes Jónsson (CoRR, 2025)