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RSS Feeds[ASAP] Density Functional Calculations of Electron Paramagnetic Resonance g- and Hyperfine-Coupling Tensors Using the Exact Two-Component (X2C) Transformation and Efficient Approximations to the Two-Electron Spin-Orbit Terms (Journal of Physical Chemistry A)

 
 

26 june 2019 00:00:33

 
[ASAP] Density Functional Calculations of Electron Paramagnetic Resonance g- and Hyperfine-Coupling Tensors Using the Exact Two-Component (X2C) Transformation and Efficient Approximations to the Two-Electron Spin-Orbit Terms (Journal of Physical Chemistry A)
 
The Journal of Physical Chemistry ADOI: 10.1021/acs.jpca.9b03979


 
73 viewsCategory: Chemistry, Physics
 
[ASAP] Tris(butadiene) Metal Complexes of the First-Row Transition Metals versus Coupling of Butadiene to Eight- and Twelve-Carbon Hydrocarbon Chains (Journal of Physical Chemistry A)
[ASAP] Accurate CHIPR Potential Energy Surface for the Lowest Triplet State of C3 (Journal of Physical Chemistry A)
 
 
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