01212nam a2200193Ia 4500 CTU_237288 210402s9999 xx 000 0 und d 620.11299 C738 Computer simulation of materials at atomic level Edited by Péter Deák, Thomas Frauenheim, Mark R. Pederson Berlin Wiley 2000 Combining theory and applications, this book deals with the modelling of materials properties and phenomena at atomic level. The first part provides an overview of the state of the art of computational solid state physics. Emphasis is given on the understanding of approximations and their consequences regarding the accuracy of the results. This part of the book also deals as a guide to find the best method for a given purpose. The second part offers a potpourri of interesting topical applications, showing what can be achieved by computational modelling. Here the possibilities and the limits of the methods are stressed. Vật liệu,Materials Mô phỏng máy tính,Computer simulation dqhieu Trung tâm Học liệu Trường Đại học Cần Thơ