Quantum chemistry is simulating atomistic systems according to the laws of quantum mechanics, and such simulations are essential for our understanding of the world and for technological progress. Machine learning revolutionizes quantum chemistry by i...Loe edasi...
Quantum chemistry is simulating atomistic systems according to the laws of quantum mechanics, and such simulations are essential for our understanding of the world and for technological progress. Machine learning revolutionizes quantum chemistry by i...Loe edasi...
Computational Methods in Organometallic Catalysis Discover recent advances in the mechanistic study of organometallic catalysisIn Computational Methods in Organometallic Catalysis: From Elementary Reactions to Mechanisms, distinguished chemist and au...Loe edasi...
(Ilmumisaeg: 10-Mar-2021, EPUB+DRM, Kirjastus: Taylor & Francis Ltd, ISBN-13: 9781000344752)
Computational Quantum Chemistry, Second Edition, is an extremely useful tool for teaching and research alike. It stipulates information in an accessible manner for scientific investigators, researchers and entrepreneurs. The book supplies an overview...Loe edasi...
(Ilmumisaeg: 10-Mar-2021, PDF+DRM, Kirjastus: Taylor & Francis Ltd, ISBN-13: 9781000344691)
Computational Quantum Chemistry, Second Edition, is an extremely useful tool for teaching and research alike. It stipulates information in an accessible manner for scientific investigators, researchers and entrepreneurs. The book supplies an overview...Loe edasi...
Computational Quantum Chemistry: Insights into Polymerization Reactions consolidates extensive research results, couples them with computational quantum chemistry (CQC) methods applicable to polymerization reactions, and presents those results system...Loe edasi...
Computational Quantum Chemistry: Insights into Polymerization Reactions consolidates extensive research results, couples them with computational quantum chemistry (CQC) methods applicable to polymerization reactions, and presents those results system...Loe edasi...
(Ilmumisaeg: 09-May-2016, PDF+DRM, Kirjastus: Springer International Publishing AG, ISBN-13: 9783319302928)
This book explains how the partial differential equations (pdes) in electroanalytical chemistry can be solved numerically. It guides the reader through the topic in a very didactic way, by first introducing and discussing the basic equations along wi...Loe edasi...
Jean-Louis Rivail, Manuel Ruiz-Lopez, Xavier Assfeld
Sari: Challenges and Advances in Computational Chemistry and Physics
(Ilmumisaeg: 13-Oct-2015, PDF+DRM, Kirjastus: Springer International Publishing AG, ISBN-13: 9783319216263)
This multi-author contributed volume includes methodological advances and original applications to actual chemical or biochemical phenomena which were not possible before the increased sophistication of modern computers. The chapters contain detailed...Loe edasi...
Sari: Theoretical and Computational Chemistry Series
(Ilmumisaeg: 17-Jun-2013, PDF+DRM, Kirjastus: Royal Society of Chemistry, ISBN-13: 9781849737289)
Computational Quantum Chemistry presents computational electronic structure theory as practised in terms of ab initio waveform methods and density functional approaches. Getting a full grasp of the field can often prove difficult, since essential top...Loe edasi...
(Ilmumisaeg: 01-Jun-2013, PDF+DRM, Kirjastus: Nova Science Publishers Inc, ISBN-13: 9781614709213)
This book is one of many volumes which presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effec...Loe edasi...
(Ilmumisaeg: 01-May-2013, PDF+DRM, Kirjastus: Nova Science Publishers Inc, ISBN-13: 9781614709220)
This book is one of many volumes which presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effec...Loe edasi...
(Ilmumisaeg: 01-May-2013, PDF+DRM, Kirjastus: Nova Science Publishers Inc, ISBN-13: 9781628084368)
This book presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effect advancements for the improv...Loe edasi...
(Ilmumisaeg: 19-Feb-2013, EPUB+DRM, Kirjastus: John Wiley & Sons Inc, ISBN-13: 9781118617243)
Over the past several decades there have been major advances in our ability to computationally evaluate the electronic structure of inorganic molecules, particularly transition metal systems. This advancement is due to the Moore s Law increase in com...Loe edasi...
(Ilmumisaeg: 19-Feb-2013, PDF+DRM, Kirjastus: John Wiley & Sons Inc, ISBN-13: 9781118617236)
Over the past several decades there have been major advances in our ability to computationally evaluate the electronic structure of inorganic molecules, particularly transition metal systems. This advancement is due to the Moore s Law increase in com...Loe edasi...
This corrected second edition contains new material which includes solvent effects, the treatment of singlet diradicals, and the fundamentals of computaional chemistry. "e;Computational Chemistry: Introduction to the Theory and Applications of Mo...Loe edasi...
(Ilmumisaeg: 09-Apr-2008, EPUB+DRM, Kirjastus: Taylor & Francis Inc, ISBN-13: 9781040209448)
An In-Depth View of Hardware Issues, Programming Practices, and Implementation of Key MethodsExploring the challenges of parallel programming from the perspective of quantum chemists, Parallel Computing in Quantum Chemistry thoroughly covers topics r...Loe edasi...
(Ilmumisaeg: 09-Apr-2008, PDF+DRM, Kirjastus: Taylor & Francis Inc, ISBN-13: 9781420051650)
An In-Depth View of Hardware Issues, Programming Practices, and Implementation of Key MethodsExploring the challenges of parallel programming from the perspective of quantum chemists, Parallel Computing in Quantum Chemistry thoroughly covers topics r...Loe edasi...
(Ilmumisaeg: 01-Dec-2007, PDF+DRM, Kirjastus: Nova Science Publishers Inc, ISBN-13: 9781614709398)
This book is one of many volumes which presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effec...Loe edasi...
(Ilmumisaeg: 01-Oct-2007, PDF+DRM, Kirjastus: Nova Science Publishers Inc, ISBN-13: 9781624173981)
This book presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effect advancements for the improv...Loe edasi...
