✦ LIBER ✦

[Theoretical and Computational Chemistry] Modern Density Functional Theory - A Tool for Chemistry Volume 2 || Density functional studies of decomposition processes of energetic molecules

✍ Scribed by Politzer, Peter

Book ID: 120414836
Publisher: Elsevier
Year: 1995
Tongue: English
Weight: 460 KB
Category: Article
ISBN: 0444821716
ISSN: 1380-7323
DOI: 10.1016/S1380-7323(05)80041-X

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

ChemInform Abstract: Density Functional

ChemInform Abstract: Density Functional Theory — A Powerful Tool for Theoretical Studies in Coordination Chemistry

✍ H. Chermette 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 23 KB 👁 1 views

[Theoretical and Computational Chemistry

[Theoretical and Computational Chemistry] Modern Density Functional Theory - A Tool for Chemistry Volume 2 || Constrained optimization procedure for finding transition states and reaction pathways in the framework of gaussian based density functional method: the case of isomerization reactions

✍ Abashkin, Y. 📂 Article 📅 1995 🏛 Elsevier 🌐 English ⚖ 766 KB

[Theoretical and Computational Chemistry

[Theoretical and Computational Chemistry] Theoretical Aspects of Chemical Reactivity Volume 19 || Chapter 2 Density functional theory models of reactivity based on an energetic criterion

✍ Cedillo, Andrés 📂 Article 📅 2007 🏛 Elsevier 🌐 English ⚖ 229 KB

**Theoretical Aspects of Chemical Reactivity** provides a broad overview of recent theoretical and computational advancements in the field of chemical reactivity. Contributions have been made by a number of leaders in the field covering theoretical developments to applications in molecular systems a

ChemInform Abstract: Density-Functional

ChemInform Abstract: Density-Functional Theory as a Practical Tool in Studies of Transition Metal Chemistry and Catalysis

✍ T. ZIEGLER 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 24 KB 👁 2 views

Handbook of Computational Chemistry Volu

Handbook of Computational Chemistry Volume 35 || Directions for Use of Density Functional Theory: A Short Instruction Manual for Chemists

✍ Leszczynski, Jerzy 📂 Article 📅 2012 🏛 Springer Netherlands ⚖ 713 KB

Theoretical study onβ-aminoacroleine; De

Theoretical study onβ-aminoacroleine; Density functional theory, atoms in molecules theory and natural bond orbitals studies

✍ HEIDAR RAISSI, MEHDI YOOSEFIAN, EFFAT MOSHFEGHI, FARZANEH FARZAD 📂 Article 📅 2012 🏛 Indian Academy of Sciences,Royal Society of Chemis 🌐 English ⚖ 303 KB