Ab Initio Study of the Two-Photon Circular Dichroism in Chiral Natural Amino Acids

The Journal of Physical Chemistry B ◽

10.1021/jp070357q ◽

2007 ◽

Vol 111 (9) ◽

pp. 2409-2414 ◽

Author(s):

Branislav Jansík ◽

Antonio Rizzo ◽

Hans Ågren

Keyword(s):

Amino Acids ◽

Circular Dichroism ◽

Ab Initio ◽

Ab Initio Study ◽

Natural Amino Acids ◽

Circular Dichroïsm

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Ab Initio Study of the Two-Photon Circular Dichroism in Chiral Natural Amino Acids

The Journal of Physical Chemistry B ◽

10.1021/jp0653555 ◽

2007 ◽

Vol 111 (2) ◽

pp. 446-460 ◽

Author(s):

Branislav Jansík ◽

Antonio Rizzo ◽

Hans Ågren

Keyword(s):

Amino Acids ◽

Circular Dichroism ◽

Ab Initio ◽

Ab Initio Study ◽

Natural Amino Acids ◽

Circular Dichroïsm

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Ab initio study of the one- and two-photon circular dichroism of R-(+)-3-methyl-cyclopentanone

The Journal of Chemical Physics ◽

10.1063/1.2907727 ◽

2008 ◽

Vol 128 (16) ◽

pp. 164312 ◽

Author(s):

Antonio Rizzo ◽

Na Lin ◽

Kenneth Ruud

Keyword(s):

Circular Dichroism ◽

Ab Initio ◽

Ab Initio Study ◽

The One ◽

Circular Dichroïsm

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Ab Initio Study of Circular Dichroism and Circularly Polarized Luminescence of Spin-Allowed and Spin-Forbidden Transitions: From Organic Ketones to Lanthanide Complexes

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.9b00286 ◽

2019 ◽

Vol 15 (7) ◽

pp. 4140-4155 ◽

Author(s):

Frédéric Gendron ◽

Barry Moore II ◽

Olivier Cador ◽

Fabrice Pointillart ◽

Jochen Autschbach ◽

...

Keyword(s):

Circular Dichroism ◽

Ab Initio ◽

Lanthanide Complexes ◽

Ab Initio Study ◽

Circularly Polarized ◽

Circularly Polarized Luminescence ◽

Forbidden Transitions ◽

Polarized Luminescence ◽

Circular Dichroïsm

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Ab initio study of the circular intensity difference in electric-field-induced second harmonic generation of chiral natural amino acids

Physical Chemistry Chemical Physics ◽

10.1039/c2cp42792c ◽

2013 ◽

Vol 15 (4) ◽

pp. 1198-1207 ◽

Author(s):

Antonio Rizzo ◽

Hans Ågren

Keyword(s):

Amino Acids ◽

Electric Field ◽

Second Harmonic Generation ◽

Ab Initio ◽

Harmonic Generation ◽

Second Harmonic ◽

Intensity Difference ◽

Ab Initio Study ◽

Natural Amino Acids

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Ab initio study of excited state electronic circular dichroism. Two prototype cases: Methyl oxirane and R-(+)-1,1′-bi(2-naphthol)

The Journal of Chemical Physics ◽

10.1063/1.3602219 ◽

2011 ◽

Vol 134 (24) ◽

pp. 244109 ◽

Author(s):

Antonio Rizzo ◽

Olav Vahtras

Keyword(s):

Circular Dichroism ◽

Excited State ◽

Ab Initio ◽

Ab Initio Study ◽

Electronic Circular Dichroism ◽

Circular Dichroïsm

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Ab-initio study of X-ray absorption and X-ray magnetic circular dichroism spectra of Mn2PtGa and Co2PtGa alloys

Journal of Magnetism and Magnetic Materials ◽

10.1016/j.jmmm.2018.06.082 ◽

2018 ◽

Vol 466 ◽

pp. 143-149

Author(s):

Tufan Roy ◽

Arup Banerjee ◽

Rajeev Dutt ◽

J. Nayak ◽

M. Maniraj ◽

...

Keyword(s):

Circular Dichroism ◽

Ab Initio ◽

Magnetic Circular Dichroism ◽

Ab Initio Study ◽

Circular Dichroism Spectra ◽

X Ray ◽

X Ray Absorption ◽

Circular Dichroïsm ◽

Magnetic Circular Dichroism Spectra

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Overcoming the existent computational challenges in the ab initio calculations of the two-photon circular dichroism spectra of large molecules using a fragment-recombination approach

Chemical Physics Letters ◽

10.1016/j.cplett.2013.03.019 ◽

2013 ◽

Vol 568-569 ◽

pp. 176-183 ◽

Author(s):

Carlos Diaz ◽

Lorenzo Echevarria ◽

Florencio E. Hernández

Keyword(s):

Circular Dichroism ◽

Ab Initio Calculations ◽

Ab Initio ◽

Circular Dichroism Spectra ◽

Large Molecules ◽

Circular Dichroïsm

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An ab initio study on the correlation between the absolute configuration and circular dichroism spectra of organic peroxides

Journal of Molecular Structure THEOCHEM ◽

10.1016/0166-1280(93)87098-x ◽

1993 ◽

Vol 280 (1) ◽

pp. 101-106 ◽

Author(s):

Jing-Jiang Liu ◽

Gui-Lin Duan ◽

Xiao-Tian Liang

Keyword(s):

Circular Dichroism ◽

Ab Initio ◽

Absolute Configuration ◽

Organic Peroxides ◽

Ab Initio Study ◽

Circular Dichroism Spectra ◽

The Absolute ◽

Circular Dichroïsm

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Amino acids and peptides. XCVIII. Synthesis and circular dichroism of two diastereomeric cyclohexapeptides containing glycine, S-benzylcysteine, and leucine

Collection of Czechoslovak Chemical Communications ◽

10.1135/cccc19703557 ◽

1970 ◽

Vol 35 (12) ◽

pp. 3557-3571 ◽

Author(s):

K. Bláha ◽

I. Frič ◽

Z. Bezpalova ◽

O. Kaurov

Keyword(s):

Amino Acids ◽

Circular Dichroism ◽

Circular Dichroïsm

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Multireference ab initio studies of zero-field splitting and magnetic circular dichroism spectra of tetrahedral Co(ii) complexes

Dalton Transactions ◽

10.1039/b902743b ◽

2009 ◽

pp. 6021 ◽

Author(s):

Mahesh Sundararajan ◽

Dmitry Ganyushin ◽

Shengfa Ye ◽

Frank Neese

Keyword(s):

Circular Dichroism ◽

Ab Initio ◽

Magnetic Circular Dichroism ◽

Zero Field Splitting ◽

Circular Dichroism Spectra ◽

Field Splitting ◽

Circular Dichroïsm ◽

Magnetic Circular Dichroism Spectra

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