phonon dispersion relation
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Author(s):  
Benjamin Ramberger ◽  
Georg Kresse

Using correlated wave function based methods, the modeling of promising new materials is elevated to a new level. For the first time, a realistic phonon dispersion relation is predicted for the infinite linear carbon chain.



2020 ◽  
Vol MA2020-02 (24) ◽  
pp. 1773-1773
Author(s):  
Ryo Yokogawa ◽  
Haruki Takeuchi ◽  
Yasutomo Arai ◽  
Ichiro Yonenaga ◽  
Hiroshi Uchiyama ◽  
...  


2020 ◽  
Vol 124 (42) ◽  
pp. 23027-23037
Author(s):  
Devin McGlamery ◽  
Alexander A. Baker ◽  
Yi-Sheng Liu ◽  
Martín A. Mosquera ◽  
Nicholas P. Stadie


2020 ◽  
Vol 98 (5) ◽  
pp. 465-472
Author(s):  
Ryo Yokogawa ◽  
Haruki Takeuchi ◽  
Yasutomo Arai ◽  
Ichiro Yonenaga ◽  
Hiroshi Uchiyama ◽  
...  


2019 ◽  
Vol 3 (4) ◽  
Author(s):  
R. Mittal ◽  
M. K. Gupta ◽  
Baltej Singh ◽  
L. Pintschovius ◽  
Yu D. Zavartsev ◽  
...  


2019 ◽  
Vol 162 ◽  
pp. 411-424 ◽  
Author(s):  
Xiu-Hui Hou ◽  
Xiao-Jian Xu ◽  
Jun-Miao Meng ◽  
Yong-Bin Ma ◽  
Zi-Chen Deng


2017 ◽  
Vol 96 (9) ◽  
Author(s):  
Khalil Zakeri ◽  
Tobias Engelhardt ◽  
Thomas Wolf ◽  
Matthieu Le Tacon


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