What are the most efficient basis set strategies for correlated wave function calculations of reaction energies and barrier heights?
2012 ◽
Vol 137
(6)
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pp. 064110
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2021 ◽
Keyword(s):
2019 ◽
1991 ◽
pp. 1255
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2001 ◽
Vol 537
(1-3)
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pp. 245-251
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2012 ◽
Vol 183
(12)
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pp. 2528-2534
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Keyword(s):
2000 ◽
Vol 112
(21)
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pp. 9229-9242
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2011 ◽
Vol 7
(9)
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pp. 2780-2785
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Keyword(s):