Open Daily: 10am - 10pm | Alley door pickup 10am - 7pm 3038 Hennepin Ave Minneapolis, MN
612-822-4611

  • Open Daily: 10am - 10pm
    Alley-side Pickup: 10am - 7pm

    3038 Hennepin Ave Minneapolis, MN
    612-822-4611

Open Daily: 10am - 10pm | Alley-side Pickup: 10am - 7pm
3038 Hennepin Ave Minneapolis, MN
612-822-4611
Density Functional Theory: Recent Advances, New Perspectives and Applications

Density Functional Theory: Recent Advances, New Perspectives and Applications

Glossman-Mitnik, Daniel

Hardcover

Physics

ISBN10: 1839698454
ISBN13: 9781839698453
Publisher: Intechopen
Published: May 18 2022
Pages: 330
Weight: 1.60
Height: 0.75 Width: 6.69 Depth: 9.61
Language: English
Density Functional Theory (DFT) is a powerful technique for calculating and comprehending the molecular and electrical structure of atoms, molecules, clusters, and solids. Its use is based not only on the capacity to calculate the molecular characteristics of the species of interest but also on the provision of interesting concepts that aid in a better understanding of the chemical reactivity of the systems under study. This book presents examples of recent advances, new perspectives, and applications of DFT for the understanding of chemical reactivity through descriptors forming the basis of Conceptual DFT as well as the application of the theory and its related computational procedures in the determination of the molecular properties of different systems of academic, social, and industrial interest.

Also from

Glossman-Mitnik, Daniel

View All

Also in

Physics

View All