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Computational data for selection of PBE+50HFX functional for studying Ru-Cl/H-PR3 complexes
info
dataset
oleh
Robert K Szilagyi
,
Savio
Poovathingal
,
Timothy K Minton
Terbitan:
2018
Available online:
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Computational data for selection of PBE+50HFX functional for studying Ru-Cl/H-PR3 complexes
info
dataset
oleh
Robert K Szilagyi
,
Savio
Poovathingal
,
Timothy K Minton
Terbitan:
2018
Available online:
Get online
Favorit
Tersimpan di:
Computational data for selection of PBE+50HFX functional for studying Ru-Cl/H-PR3 complexes
info
dataset
oleh
Robert K Szilagyi
,
Savio
Poovathingal
,
Timothy K Minton
Terbitan:
2018
Available online:
Get online
Favorit
Tersimpan di:
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Related Subjects
ab initio wave function
basis set saturation limit
chloro
density functional theory
homogeneous complex speciation
hydrido
phosphino ligands
reactive-atom scattering
ruthenium complexes
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