Geometry optimization using improved virtual orbitals: A complete active space numerical gradient approach
2007 ◽
Vol 126
(11)
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pp. 114103
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Keyword(s):
2010 ◽
Vol 132
(3)
◽
pp. 034105
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2011 ◽
Vol 115
(16)
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pp. 3665-3678
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2015 ◽
Vol 143
(2)
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pp. 024109
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Keyword(s):
2006 ◽
Vol 107
(3)
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pp. 694-702
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Keyword(s):
2017 ◽
Vol 147
(23)
◽
pp. 234109
◽
2017 ◽
Vol 13
(10)
◽
pp. 4829-4840
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2020 ◽
Vol 16
(5)
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pp. 3445-3445
Keyword(s):
2014 ◽
Vol 141
(15)
◽
pp. 154303
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