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Asymptotic theory for the 2∑u Van der Waals potentials of alkali dimer cations

✍ Scribed by Ch. Johann; S.H. Patil; K.T. Tang; J.P. Toennies


Book ID
108312589
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
139 KB
Volume
295
Category
Article
ISSN
0009-2614

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Interaction potential for He/H2 includin
✍ B. Tsapline; W. Kutzelnigg 📂 Article 📅 1973 🏛 Elsevier Science 🌐 English ⚖ 411 KB

The energy of He/H2 in its pound state is calculated in an abminitio way using the IEPA PNO method for three different H-H distances, three different angles and for distances between He and the midpoint of H2 racging from 3 to 2000. A van der Waals minimum of ==21"K is found for the linear arrangem