Fabien Gatti's Books

Applications of Quantum Dynamics in Chemistry

By: Fabien Gatti,Benjamin Lasorne,Hans-Dieter Meyer,André Nauts

Write a review Read reviews Take a Quiz Solve Book Puzzle

Applications of Quantum Dynamics in Chemistry

By: Fabien Gatti,Benjamin Lasorne,Hans-Dieter Meyer,André Nauts

This book explains the usage and application of Molecular Quantum Dynamics, the methodology where both the electrons and the nuclei in a molecule are treated with quantum mechanical calculations. This volume of Lecture Notes in Chemistry addresses graduate students and postdocs in the field of theoretical chemistry, as well as postgraduate students, researchers and teachers from neighboring fields, such as quantum physics, biochemistry, biophysics, or anyone else who is interested in this rising method in theoretical chemistry, and who wants to gain experience in the opportunities it can offer. It can also be useful for teachers interested in illustrative examples of time-dependent quantum mechanics as animations of realistic wave packets have been designed to assist in visualization. Assuming a basic knowledge about quantum mechanics, the authors link their explanations to recent experimental investigations where Molecular Quantum Dynamics proved successful and necessary for the understanding of the experimental results. Examples including reactive scattering, photochemistry, tunneling, femto- and attosecond chemistry and spectroscopy, cold chemistry or crossed-beam experiments illustrate the power of the method. The book restricts complicated formalism to the necessary and in a self-contained and clearly explained way, offering the reader an introduction to, and instructions for, practical exercises. Continuative explanation and math are optionally supplemented for the interested reader. The reader learns how to apply example simulations with the MCTDH program package (Multi Configuration Time Dependent Hartree calculations). Readers can thus obtain the tools to run their own simulations and apply them to their problems. Selected scripts and program code from the examples are made available as supplementary material. This book bridges the gap between the existing textbooks on fundamental theoretical chemistry and research monographs focusing on sophisticated applications. It is a must-read for everyone who wants to gain a sound understanding of Molecular Quantum Dynamics simulations and to obtain basic experience in running their own simulations.

Average ratings

N/A

Write a review

Solve jigsaw puzzle

Age

Page Count

437

Publisher

Springer

Published Date

ISBN 10

331953923X

ISBN 13

9783319539232

Heuristic and Knowledge-Based Security Checks of Source Code Artifacts Using Community Knowledge

By: Fabien Patrick Viertel

Write a review Read reviews Take a Quiz Solve Book Puzzle

Heuristic and Knowledge-Based Security Checks of Source Code Artifacts Using Community Knowledge

By: Fabien Patrick Viertel

The goal of this dissertation is to support developers in applying security checks using community knowledge. Artificial intelligence approaches combined with natural language processing techniques are employed to identify security-related information from community websites such as Stack Overflow or GitHub. All security-related information is stored in a security knowledge base. This knowledge base provides code fragments that represent the community´s knowledge about vulnerabilities, security-patches, and exploits. Comprehensive knowledge is required to carry out security checks on software artifacts, such as data covering known vulnerabilities and their manifestation in the source code as well as possible attack strategies. Approaches that check software libraries and source code fragments are provided for the automated use of the data. Insecure software libraries can be detected using the NVD combined with metadata and library file hash approaches introduced in this dissertation. Vulnerable source code fragments can be identified using community knowledge represented by code fragments extracted from the largest coding community websites: Stack Overflow and GitHub. A state-of-the-art clone detection approach is modified and enriched by several heuristics to enable vulnerability detection and leverage community knowledge while maintaining good performance. Using various case studies, the approaches implemented in Eclipse plugins and a JIRA plugin are adapted to the users´ needs and evaluated.

Average ratings

N/A

Write a review

Solve jigsaw puzzle

Age

Page Count

225

Publisher

Logos Verlag Berlin GmbH

Published Date

ISBN 10

3832553495

ISBN 13

9783832553494

Applications of Quantum Dynamics in Chemistry

By: Fabien Gatti,Benjamin Lasorne,Hans-Dieter Meyer,André Nauts

Write a review Read reviews Take a Quiz Solve Book Puzzle

Applications of Quantum Dynamics in Chemistry

By: Fabien Gatti,Benjamin Lasorne,Hans-Dieter Meyer,André Nauts

Average ratings

N/A

Write a review

Solve jigsaw puzzle

Age

Page Count

437

Publisher

Springer

Published Date

ISBN 10

331953923X

ISBN 13

9783319539232

Book's by Fabien Gatti

Applications of Quantum Dynamics in Chemistry

Applications of Quantum Dynamics in Chemistry

Heuristic and Knowledge-Based Security Checks of Source Code Artifacts Using Community Knowledge

Heuristic and Knowledge-Based Security Checks of Source Code Artifacts Using Community Knowledge

Applications of Quantum Dynamics in Chemistry

Applications of Quantum Dynamics in Chemistry

Username

Password

Username

Password

Password again

Birthday

Email