Time-dependent density functional theory/discrete reaction field spectra of open shell systems: The visual spectrum of [FeIII(PyPepS)2]− in aqueous solution
2007 ◽
Vol 127
(4)
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pp. 045105
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Keyword(s):
2020 ◽
Vol 153
(16)
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pp. 164109
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Keyword(s):
Time-dependent density-functional theory investigation of excitation spectra of open-shell molecules
2000 ◽
Vol 527
(1-3)
◽
pp. 229-244
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Keyword(s):
2006 ◽
Vol 124
(14)
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pp. 144105
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2008 ◽
Vol 112
(40)
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pp. 9796-9800
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2004 ◽
Vol 102
(23-24)
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pp. 2585-2595
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Keyword(s):
2019 ◽
Vol 151
(18)
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pp. 184111
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Keyword(s):
2010 ◽
Vol 31
(11)
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pp. 2157-2163
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2009 ◽
Vol 914
(1-3)
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pp. 60-73
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2011 ◽
Vol 134
(13)
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pp. 134101
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Keyword(s):
2018 ◽
Vol 149
(7)
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pp. 074102
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Keyword(s):