Sort by
Refine Your Search
-
Listed
-
Category
-
Country
-
Program
-
Field
-
to apply. We seek candidates with expertise in some or all the following areas: density functional theory, deep learning, high-throughput simulations, molecular dynamics, and materials chemistry. Strong
-
NIST only participates in the February and August reviews. First principles calculations, usually based on density functional theory (DFT), are a crucial aspect of modern materials physics research
-
research on 2D materials, including ferroelectric, multiferroic, topological, and moiré systems. Develop, implement, and apply advanced simulation techniques (e.g., density functional theory, tight-binding
-
. Responsibilities and qualifications The main focus of the job is to do computational research using Density Functional theory calculations to understand spin-mediated promotion effects in heterogeneous catalysis
-
, (https://mpzpm.mpg.de/). Both theory- and experiment- oriented researchers are encouraged to apply. Outstanding applicants will be invited to a scientific symposium and interview on July 20-21, 2026. In
-
computational research using Density Functional theory calculations to understand spin-mediated promotion effects in heterogeneous catalysis, particularly ammonia decomposition and CO2 hydrogenation. You need
-
energy density matter , High Energy Experimental , High Energy Physics , high energy physics or mathematical physics , High Energy Theory , High Energy Theory Group , High Performance Computing
-
Functional Theory (DFT) Familiarity with artificial intelligence methods Good knowledge of electronic structure methods Experience with Linux, Git and related tools Knowledge in the field of high-performance
-
to determine these materials’ chemical structure and its effect on their properties. This project will use theoretical modelling (density-functional theory and Monte Carlo calculations) to investigate
-
software (e.g., Gaussian, Dalton, TurboMole) is highly desirable. Experience in Density Functional Theory (DFT) and Time-Dependent Density Functional Theory (TD-DFT) are desirable assets. Strong analytical