Hannes Jónsson

Available identifiers

zbMath Open jonsson.hannesWikidataQ52653868 ScholiaQ52653868MaRDI QIDQ975021

List of research outcomes

Publication	Date of Publication	Type
Dataset for the article "A Neural-Network-Based Selective Configuration Interaction Approach to Molecular Electronic Structure"	2025-01-25	Dataset
Supporting data set for: Sulfur-deficient edges as active sites for hydrogen evolution on MoS2	2023-11-06	Dataset
Dataset for the manuscript 'Orbital-optimized Density Functional Calculations of Molecular Rydberg Excited States with Real Space Grid Representation and Self-Interaction Correction'	2023-10-25	Dataset
Data for the manuscript "Improved Initialisation of Optimal Path Calculations Using Stepwise Traversal over the Image Dependent Pair Potential Surface"	2023-09-20	Dataset
Direct energy minimization based on exponential transformation in density functional calculations of finite and extended systems	2023-06-14	Paper
Optimal atomic structure of amorphous silicon obtained from density functional theory calculations	2023-06-14	Paper
Data for the manuscript "Calculations of Excited Electronic States by Converging on Saddle Points Using Generalized Mode Following"	2023-03-29	Dataset
Supporting data set for: On the challenge of obtaining an accurate solvation energy estimate in simulations of electrocatalysis	2023-03-03	Dataset
Supporting data set for: Simulations of the Electrochemical Oxidation of Shape-Selected Nanoparticle Catalysts	2022-03-02	Dataset
Efficient sampling of saddle points with the minimum-mode following method	2011-10-28	Paper
Distributed implementation of the adaptive kinetic Monte Carlo method	2010-06-08	Paper

Research outcomes over time

This page was built for person: Hannes Jónsson