Communications

Intramolecular basis set superposition error as a measure of basis set incompleteness: Can one reach the basis set limit without extrapolation?


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Author / Producer

Date

2010

Publication Type

Journal Article

ETH Bibliography

yes

Citations

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Data

Rights / License

Publication status

published

Editor

Book title

Volume

132 (21)

Pages / Article No.

211103

Publisher

American Institute of Physics

Event

Edition / version

Methods

Software

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Date collected

Date created

Subject

ab initio calculations; ammonia; carbon compounds; error analysis; nitrogen; organic compounds; perturbation theory; Schrodinger equation; water

Organisational unit

Notes

Received 20 December 2009, Accepted 19 April 2010, Published online 7 June 2010.

Funding

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