Advances in Quantum Chemistry
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9780120348374
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Relativistic density functional calculations for potential energy curves of uranyl nitrate hydrate

2000 ◽  
pp. 325-333
Author(s):  
Masaru Hirata ◽  
Turgut Bastug ◽  
Shoichi Tachimori ◽  
Rika Sekine ◽  
Jun Onoe ◽  
...  
Keyword(s):  
Potential Energy ◽  
Uranyl Nitrate ◽  
Density Functional Calculations ◽  
Density Functional ◽  
Potential Energy Curves ◽  
Nitrate Hydrate

CO shakeup calculations with the DV-Xα method

2000 ◽  
pp. 127-137
Author(s):  
Akio Shigemi ◽  
Hirohide Nakamatsu ◽  
Takeshi Mukoyama ◽  
Shigero Ikeda

The electronic states in Ca-doped BaTiO3 ceramics

2000 ◽  
pp. 179-191 ◽  
Author(s):  
Myung Chul Chang ◽  
Soo-Chang Yu
Keyword(s):  
Electronic States
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