Python for quantum chemistry : a full stack programming guide /

Quantum chemistry requires ever higher computational performance, with more and more sophisticated and dedicated Python scripts being required to solve challenging problems.Although resources for basic use of Python are widely (and often freely) available online and in literature, truly cohesive mat...

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Bibliographic Details
Main Author: Sun, Qiming (Author)
Corporate Author: ScienceDirect (Online service)
Format: eBook
Language:English
Published: Amsterdam, Netherlands : Elsevier, 2025.
Series:Theoretical and computational chemistry ; 23.
Subjects:
Online Access:Connect to the full text of this electronic book
Description
Summary:Quantum chemistry requires ever higher computational performance, with more and more sophisticated and dedicated Python scripts being required to solve challenging problems.Although resources for basic use of Python are widely (and often freely) available online and in literature, truly cohesive materials for advanced Python programming skills.
Physical Description:1 online resource.
Bibliography:Includes bibliographical references and index.
ISBN:0443238367
9780443238369