Exact-exchange Hartree–Fock calculations for periodic systems

1981 ◽  
Vol 44 (3) ◽  
pp. 413-418 ◽  
Author(s):  
G. Angonoa ◽  
R. Dovesi ◽  
C. Pisani ◽  
C. Roetti
Keyword(s):  
Periodic Systems ◽  
Hartree Fock ◽  
Exact Exchange

Exact–exchange Hartree–Fock calculations for periodic systems

1981 ◽  
Vol 44 (3) ◽  
pp. 419-425 ◽  
Author(s):  
M. Causγ ◽  
R. Dovesi ◽  
C. Pisani ◽  
C. Roetti
Keyword(s):  
Periodic Systems ◽  
Hartree Fock ◽  
Exact Exchange

Exact-exchange Hartree-Fock calculations for periodic systems. III. Ground-state properties of diamond

1980 ◽  
Vol 22 (12) ◽  
pp. 5936-5944 ◽  
Author(s):  
R. Dovesi ◽  
C. Pisani ◽  
F. Ricca ◽  
C. Roetti
Keyword(s):  
Ground State ◽  
Periodic Systems ◽  
Hartree Fock ◽  
Ground State Properties ◽  
Exact Exchange

scholarly journals Treatment of the exchange interactions in Hartree-Fock LCAO calculations of periodic systems

1988 ◽  
Vol 92 (4) ◽  
pp. 909-913 ◽  
Author(s):  
M. Causa ◽  
R. Dovesi ◽  
R. Orlando ◽  
Cesare Pisani ◽  
V. R. Saunders
Keyword(s):  
Exchange Interactions ◽  
Periodic Systems ◽  
Hartree Fock

Effect of Hartree-Fock exact exchange on intramolecular magnetic coupling constants of organic diradicals

2015 ◽  
Vol 142 (2) ◽  
pp. 024318 ◽  
Author(s):  
Daeheum Cho ◽  
Kyoung Chul Ko ◽  
Yasuhiro Ikabata ◽  
Kazufumi Wakayama ◽  
Takeshi Yoshikawa ◽  
...  
Keyword(s):  
Magnetic Coupling ◽  
Coupling Constants ◽  
Hartree Fock ◽  
Exact Exchange
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