scholarly journals Solid-State Testing of a Van-Der-Waals-Corrected Exchange-Correlation Functional Based on the Semiclassical Atom Theory

Computation ◽  
2018 ◽  
Vol 6 (1) ◽  
pp. 7 ◽  
Author(s):  
Aleksandr Terentjev ◽  
Pietro Cortona ◽  
Lucian Constantin ◽  
José Pitarke ◽  
Fabio Della Sala ◽  
...  
Keyword(s):  
Solid State ◽  
Van Der Waals ◽  
State Testing ◽  
Exchange Correlation ◽  
Atom Theory

Solid State Testing of Inhaled Formulations

2019 ◽  
pp. 523-540
Author(s):  
Philip Chi Lip Kwok ◽  
Hak-Kim Chan
Keyword(s):  
Solid State ◽  
State Testing

Formation of a Cyclic Dimer Containing Two Mirror Image Monomers in the Solid State Controlled by van der Waals Forces

2011 ◽  
Vol 13 (18) ◽  
pp. 4818-4821 ◽  
Author(s):  
Zibin Zhang ◽  
Guocan Yu ◽  
Chengyou Han ◽  
Jiyong Liu ◽  
Xia Ding ◽  
...  
Keyword(s):  
Solid State ◽  
Van Der Waals ◽  
Van Der Waals Forces ◽  
Mirror Image ◽  
Cyclic Dimer

Screened hybrid meta-GGA exchange–correlation functionals for extended systems

2019 ◽  
Vol 21 (6) ◽  
pp. 3002-3015 ◽  
Author(s):  
Subrata Jana ◽  
Prasanjit Samal
Keyword(s):  
Solid State ◽  
Exchange Correlation ◽  
Hartree Fock ◽  
Extended Systems

Screened Hartree–Fock exchange integrated with semilocal exchange–correlation functionals often proficiently predict several solid-state properties.

van der Waals exchange-correlation functionals over bulk and surface properties of transition metals

2019 ◽  
Vol 31 (31) ◽  
pp. 315501 ◽  
Author(s):  
Joana Avelar ◽  
Albert Bruix ◽  
Jorge Garza ◽  
Rubicelia Vargas
Keyword(s):  
Transition Metals ◽  
Surface Properties ◽  
Van Der Waals ◽  
Exchange Correlation
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