More QR-SCMEH-MO calculations on group VIB transition metal molecules, M2 (M = Cr, Mo, W, Sg): Valence and valence-core effects

2004 ◽  
Vol 100 (6) ◽  
pp. 1170-1178 ◽  
Author(s):  
E. A. Boudreaux ◽  
E. Baxter
Keyword(s):  
Transition Metal ◽  
Mo Calculations ◽  
Transition Metal Molecules

Manganese-centered tubular boron cluster – MnB16−: A new class of transition-metal molecules

2016 ◽  
Vol 144 (15) ◽  
pp. 154310 ◽  
Author(s):  
Tian Jian ◽  
Wan-Lu Li ◽  
Ivan A. Popov ◽  
Gary V. Lopez ◽  
Xin Chen ◽  
...  
Keyword(s):  
Transition Metal ◽  
Boron Cluster ◽  
New Class ◽  
Transition Metal Molecules

Benchmark Many-Body GW and Bethe–Salpeter Calculations for Small Transition Metal Molecules

2014 ◽  
Vol 10 (9) ◽  
pp. 3934-3943 ◽  
Author(s):  
Sabine Körbel ◽  
Paul Boulanger ◽  
Ivan Duchemin ◽  
Xavier Blase ◽  
Miguel A. L. Marques ◽  
...  
Keyword(s):  
Transition Metal ◽  
Many Body ◽  
Transition Metal Molecules

Orbital localization in transition metal molecules

1991 ◽  
Vol 79 (6) ◽  
pp. 389-401 ◽  
Author(s):  
Marten A. Buijse ◽  
Evert Jan Baerends
Keyword(s):  
Transition Metal ◽  
Transition Metal Molecules
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