Response to “Comment on ‘The hyperpolarizability of trans-butadiene: A critical test case for quantum chemical models’ ” [J. Chem. Phys. 108, 4355 (1998)]

1998 ◽  
Vol 108 (10) ◽  
pp. 4358-4360 ◽  
Author(s):  
Patrick Norman ◽  
Yi Luo ◽  
Dan Jonsson ◽  
Hans Ågren
Keyword(s):  
Quantum Chemical ◽  
Chem Phys ◽  
Test Case ◽  
Critical Test ◽  
Chemical Models ◽  
Quantum Chemical Models

scholarly journals Comment on “The hyperpolarizability of trans-butadiene: A critical test case for quantum chemical models” [J. Chem. Phys. 106, 1827 (1997)]

1998 ◽  
Vol 108 (10) ◽  
pp. 4355-4357 ◽  
Author(s):  
Bernard Kirtman ◽  
Joseph L. Toto ◽  
Curt Breneman ◽  
Celso P. de Melo ◽  
David M. Bishop
Keyword(s):  
Quantum Chemical ◽  
Chem Phys ◽  
Test Case ◽  
Critical Test ◽  
Chemical Models ◽  
Quantum Chemical Models

The hyperpolarizability of trans-butadiene: A critical test case for quantum chemical models

1997 ◽  
Vol 106 (5) ◽  
pp. 1827-1835 ◽  
Author(s):  
Patrick Norman ◽  
Yi Luo ◽  
Dan Jonsson ◽  
Hans Ågren
Keyword(s):  
Quantum Chemical ◽  
Test Case ◽  
Critical Test ◽  
Chemical Models ◽  
Quantum Chemical Models

Accurate Composite and Fragment-Based Quantum Chemical Models for Large Molecules

2015 ◽  
Vol 115 (12) ◽  
pp. 5643-5677 ◽  
Author(s):  
Krishnan Raghavachari ◽  
Arjun Saha
Keyword(s):  
Quantum Chemical ◽  
Large Molecules ◽  
Chemical Models ◽  
Quantum Chemical Models

Rotating full- and reduced-dimensional quantum chemical models of molecules

2011 ◽  
Vol 134 (7) ◽  
pp. 074105 ◽  
Author(s):  
Csaba Fábri ◽  
Edit Mátyus ◽  
Attila G. Császár
Keyword(s):  
Quantum Chemical ◽  
Chemical Models ◽  
Quantum Chemical Models
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