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Research at Lancaster
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Results for EXCHANGE-CORRELATION POTENTIALS
Publications & Outputs
Shielding Constants and Chemical Shifts in DFT: Influence of Optimized Effective Potential and Coulomb-Attenuation
Peach, M. J. G.
, Kattirtzi, J. A., Teale, A. M. & Tozer, D. J.,
8/07/2010
,
In:
Journal of Physical Chemistry A.
114
,
26
,
p. 7179-7186
8 p.
Research output
:
Contribution to Journal/Magazine
›
Journal article
›
peer-review
Adiabatic connection forms in density functional theory: H(2) and the He isoelectronic series
Peach, M. J. G.
, Miller, A. M., Teale, A. M. & Tozer, D. J.,
14/08/2008
,
In:
Journal of Chemical Physics.
129
,
6
,
7 p.
, ARTN 064105.
Research output
:
Contribution to Journal/Magazine
›
Journal article
›
peer-review