There are many methods and software for simulating materials in practice today, each software or computational method has its own advantages and disadvantages. In the process of studying and researching material simulation, we found that the VASP software combined with the Density Functional Theory (DFT) method is perfect up to this point. Reliability, accuracy, and low resource and time consumption during the calculation process are the standout advantages of this combination. DFT calculations on VASP require the precise construction of input data, including the input files, and it is not necessary to write code to process the output data, which is a significant advantage compared to other methods. Output data is processed through commonly used support software such as Origin and VESTA, which is an advantage of this simulation calculation method.
Publication Information
Publisher
Thu Dau Mot University, Viet Nam
Editor-in-Chief
Assoc. Prof. Nguyen Van Hiep Thu Dau Mot University
Editorial Board
Assoc. Prof. Le Tuan Anh Thu Dau Mot University
PhD. Nguyen Quoc Cuong Thu Dau Mot University
PhD. Doan Ngoc Xuan Thu Dau Mot University
PhD. Nguyen Khoa Truong An Thu Dau Mot University
Assoc. Prof. Nguyen Thanh Binh Thu Dau Mot University
PhD. Le Thi Thuy Dung Thu Dau Mot University
PhD. Ngo Hong Diep Thu Dau Mot University
PhD. Nguyen Duc Dat Duc Ho Chi Minh City University of Industry and Trade
Assoc. Prof. Nguyen Van Duc Animal Husbandry Association of Vietnam
PhD. Nguyen Thi Nhat Hang Department of Education and Training of Binh Duong Province
PhD. Nguyen Thi Cam Le Vietnam Aviation Academy
PhD. Trần Hạnh Minh Phương Thu Dau Mot University
M.A. Pham Van Thinh Thu Dau Mot University
PhD. Nguyen Thi Lien Thuong Thu Dau Mot University