Keywords
PseudopotentialArbitrarinessBasis setChemistryBasis (linear algebra)MoleculeSeries (stratigraphy)Computational chemistryValence (chemistry)Work (physics)Atomic physicsThermodynamicsDensity functional theoryPhysicsMathematicsGeometryOrganic chemistry
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Publication Info
- Year
- 1980
- Type
- article
- Volume
- 55
- Issue
- 1
- Pages
- 43-54
- Citations
- 134
- Access
- Closed
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Cite This
Michel Pélissier,
Philippe Durand
(1980).
Testing the arbitrariness and limits of a pseudopotential technique through calculations on the series of diatoms HF, AlH, HCl, AlF, AlCl, F2, Cl2.
Theoretical Chemistry Accounts
, 55
(1)
, 43-54.
https://doi.org/10.1007/bf00551409
Identifiers
- DOI
- 10.1007/bf00551409