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The chemical hardness of molecules and the band gap of solids within charge equilibration formalisms
Müser, Martin
2012
2012
The @European physical journal / B, 85 (2012) 4, S. 135
“...Computational Science and Mathematical Methods...”
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Split-charge equilibration: A charge-transfer method for electrolytes and other dielectric materials
Müser, Martin
2012
2012
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Dapp, W.B.
2012
2012
Physical review letters, 108 (2012) S. 244301
“...Computational Science and Mathematical Methods...”Get full text OpenAccess