The importance of current contributions to shielding constants in density-functional theory
2015 ◽
Vol 17
(28)
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pp. 18834-18842
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Keyword(s):
The sources of error in the calculation of nuclear-magnetic-resonance shielding constants determined by density-functional theory are examined.
2008 ◽
Vol 4
(2)
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pp. 267-277
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2017 ◽
Vol 13
(2)
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pp. 525-536
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2003 ◽
pp. 117-168
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2002 ◽
Vol 116
(23)
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pp. 10139-10147
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2021 ◽
Vol 17
(2)
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pp. 826-840
2012 ◽
Vol 9
(7)
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pp. 953-956
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2013 ◽
Vol 184
(8)
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pp. 1827-1833
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2016 ◽
Vol 18
(31)
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pp. 21296-21304
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2012 ◽
Vol 116
(3)
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pp. 1008-1014
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