Ground-State Charge Transfer: Lithium–Benzene and the Role of Hartree–Fock Exchange

2016 ◽  
Vol 120 (41) ◽  
pp. 8190-8198 ◽  
Author(s):  
Carlos H. Borca ◽  
Lyudmila V. Slipchenko ◽  
Adam Wasserman
Keyword(s):  
Charge Transfer ◽  
Ground State ◽  
Hartree Fock ◽  
State Charge

Intramolecular excited-state charge-transfer interactions and the role of ground-state conformations

1980 ◽  
Vol 84 (21) ◽  
pp. 2696-2698 ◽  
Author(s):  
Ying Wang ◽  
Michael K. Crawford ◽  
Kenneth B. Eisenthal
Keyword(s):  
Excited State ◽  
Charge Transfer ◽  
Ground State ◽  
State Charge

SEPARATION OF INITIAL AND FINAL STATE CONTRIBUTIONS TO CHEMICAL SHIFTS IN TERMS OF A POTENTIAL MODEL

1994 ◽  
Vol 01 (04) ◽  
pp. 469-472 ◽  
Author(s):  
R.J. COLE ◽  
P. WEIGHTMAN
Keyword(s):  
Charge Transfer ◽  
Ground State ◽  
Potential Model ◽  
Chemical Shifts ◽  
Free Atom ◽  
Core Hole ◽  
Final State ◽  
State Charge ◽  
Elemental Solid

A recently developed potential model facilitates the separation of initial and final state contributions to chemical shifts in terms of ground state charge transfer and differences in core hole screening charge. The model is applied to the free atom to elemental solid shifts of the elements Na, Mg, Si, and Zn.

Ground-state charge-transfer complex formation in hybrid poly(3-hexyl thiophene):titanium dioxide solar cells

2008 ◽  
Vol 93 (22) ◽  
pp. 223302 ◽  
Author(s):  
I. Haeldermans ◽  
K. Vandewal ◽  
W. D. Oosterbaan ◽  
A. Gadisa ◽  
J. D’Haen ◽  
...  
Keyword(s):  
Titanium Dioxide ◽  
Solar Cells ◽  
Charge Transfer ◽  
Complex Formation ◽  
Ground State ◽  
Charge Transfer Complex ◽  
State Charge
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