For this study, we needed to calculate the band gaps of MOFs for which hybrid DFT would be a suitable theory. However, the cost of hybrid DFT calculations was prohibitively expensive. To overcome this ...

Are there parallels in architectural theory or practice that align with ... of the currents of the 20th century modernist movement, functionalism. Modernism could be described as one of the ...

The book provides a model for functional grammatical description that can be used to inform work on system and structure across languages as a foundation for functional language typology.

Anthropology, as the study of human cultures, societies, and behaviors, has significantly influenced the field of International Relations (IR) .

INTRODUCTION: Density functional theory (DFT) is a widely used method for calculating the electronic properties of materials. The method is based on the idea of approximating the many-electron wave ...

Merton, Robert C., and Zvi Bodie. "Financial Infrastructure and Public Policy: A Functional Perspective." Harvard Business School Working Paper, No. 95-064, January 1995.

Density functional theory is computational technique used to predict the properties of molecules and bulk materials. It is a method for investigating the electronic structure of many-body systems ...

At its core, DFT postulates that the ground-state energy of a quantum system is a functional of the electron density. This principle, known as the Hohenberg-Kohn theorem, simplifies the problem of ...