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RSS Feeds[ASAP] Automatic Active Space Selection for Calculating Electronic Excitation Energies Based on High-Spin Unrestricted Hartree-Fock Orbitals (Journal of Chemical Theory and Computation)

 
 

10 september 2019 02:04:24

 
[ASAP] Automatic Active Space Selection for Calculating Electronic Excitation Energies Based on High-Spin Unrestricted Hartree-Fock Orbitals (Journal of Chemical Theory and Computation)
 




Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b00535


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23 viewsCategory: Chemistry
 
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