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absorption fine structure), development of data-analysis approaches and computer software for simultaneous structural refinements using multiple types of data combined with ab initio theoretical modeling
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and applies quantum mechanics-based methods for the description of condensed matter systems, including the successful software package VASP (Vienna ab-initio Simulation Package). We focus
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a Research Infrastructure? No Offer Description Keywords: solid-state NMR, ab-initio molecular dynamics (AIMD), thin-film amorphous electrolytes Background and motivation: Thin-film amorphous
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the successful software package VASP (Vienna ab-initio Simulation Package). We focus on the development of methods to solve the many-electron Schrödinger equation for fermions and bosons with high accuracy and on
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software package VASP (Vienna ab-initio Simulation Package). We focus on the development of methods to solve the many-electron Schrödinger equation for fermions and bosons with high accuracy and on
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providing reference spectroscopic line-shape data based on experimentally validated ab initio quantum scattering calculations. We will fully utilize capabilities to populate spectroscopic databases and
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Sorbonne Université SIS (Sciences, Ingénierie, Santé) | Paris 15, le de France | France | 10 days ago
). This activity will be supported by ab initio calculations using density functional theory or many-body Green-function methods that take into account electronic correlations (coll. M. Helgren, B. Lenz and M
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electromagnetic phenomena, using languages such as C++ and Python Collaborate with senior researchers to formulate new theories pertaining to EUV generation, obtained ab initio from Maxwell’s equations and quantum
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Offer Description Development of atomistic ab-initio simulations and machine learning models for the study of phonon transport, phase transitions, and structural optimization of phase change materials
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Chemistry position is available for Chemical Research to work in a project on the development of new ab initio electronic structure methods led by Dr. Ramon Alain Miranda Quintana in the Department