International Conference on Electronic Structure and Density Functional Theory (ICESDFT-26)

Conference Session Tracks

Aligned with

UN SUSTAINABLE DEVELOPMENT GOALS

This conference contributes to global sustainability by aligning its research discussions and academic sessions with key United Nations Sustainable Development Goals.

SDG 9 Industry, Innovation and Infrastructure

SDG 12 Responsible Consumption and Production

TRACK 01

Advancements in Density Functional Theory

This track will explore recent developments in density functional theory (DFT) methodologies, focusing on novel hybrid f...

TRACK 02

Electronic Structure of Complex Materials

This session will delve into the electronic structure of complex materials, including transition metal oxides and topolo...

TRACK 03

Quantum Mechanics in Theoretical Chemistry

This track focuses on the application of quantum mechanics to solve problems in theoretical chemistry, emphasizing wavef...

TRACK 04

Charge Density and Chemical Bonding

This session will investigate the relationship between charge density distributions and chemical bonding in various mole...

TRACK 05

Computational Methods for Spectroscopy

This track will cover the application of computational methods to interpret and predict spectroscopic properties of mole...

TRACK 06

Ab Initio Calculations and Their Applications

This session will focus on ab initio computational methods and their applications in predicting molecular properties and...

TRACK 07

Band Structure and Electronic Transitions

This track will explore the theoretical underpinnings of band structure calculations and their implications for electron...

TRACK 08

Potential Energy Surfaces and Reaction Dynamics

This session will examine the construction and analysis of potential energy surfaces (PES) in relation to reaction dynam...

TRACK 09

Basis Set Optimization in Computational Chemistry

This track will focus on the optimization of basis sets in computational chemistry, highlighting strategies to improve c...

TRACK 10

Theoretical Approaches to Molecular Energy Levels

This session will delve into theoretical approaches for calculating molecular energy levels and their significance in ch...

TRACK 11

Exchange-Correlation Functionals in DFT

This track will focus on the development and application of exchange-correlation functionals within density functional t...

Hybrid Event