New Algorithms for Optimizing and Linking Conical Intersection Points
Sicilia, Fabrizio, Blancafort, Lluís, Bearpark, Michael J, Robb, Michael A
Published in Journal of Chemical Theory and Computation (01.02.2008)
Published in Journal of Chemical Theory and Computation (01.02.2008)
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Journal Article
Automatic generation of active coordinates for quantum dynamics calculations: Application to the dynamics of benzene photochemistry
Lasorne, Benjamin, Sicilia, Fabrizio, Bearpark, Michael J., Robb, Michael A., Worth, Graham A., Blancafort, Lluìs
Published in Journal of chemical physics online/The Journal of chemical physics/Journal of chemical physics (28.03.2008)
Published in Journal of chemical physics online/The Journal of chemical physics/Journal of chemical physics (28.03.2008)
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Journal Article
Automatic generation of active coordinates for quantum dynamics calculations: application to the dynamics of benzene photochemistry
Lasorne, Benjamin, Sicilia, Fabrizio, Bearpark, Michael J, Robb, Michael A, Worth, Graham A, Blancafort San José, Lluís
Published in The Journal of chemical physics (22.03.2011)
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Published in The Journal of chemical physics (22.03.2011)
Journal Article
An analytical second-order description of the S0/S1 intersection seam: fulvene revisited
Sicilia Fabrizio, Bearpark Michael J, Blancafort Lluìs, Robb, Michael A
Published in Theoretical chemistry accounts (01.01.2007)
Published in Theoretical chemistry accounts (01.01.2007)
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Journal Article
trans , trans , trans -Diacetonitriledibromobis(4-fluoroaniline)nickel(II)
Fawcett, John, Sicilia, Fabrizio, Solan, Gregory A
Published in Acta crystallographica. Section E (15.07.2005)
Published in Acta crystallographica. Section E (15.07.2005)
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Journal Article
trans,trans,trans‐Diacetonitriledibromobis(4‐fluoroaniline)nickel(II)
Fawcett, John, Sicilia, Fabrizio, Solan, Gregory A
Published in Acta crystallographica. Section E, Structure reports online (01.07.2005)
Published in Acta crystallographica. Section E, Structure reports online (01.07.2005)
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Journal Article
New algorithms for optimizing and linking conical intersection points
Sicilia, Fabrizio, Blancafort San José, Lluís, Bearpark, Michael J, Robb, Michael A
Year of Publication 01.02.2008
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Year of Publication 01.02.2008
Journal Article
Automatic generation of active coordinates for quantum dynamics calculations: application to the dynamics of benzene photochemistry
Lasorne, Benjamin, Sicilia, Fabrizio, Bearpark, Michael J, Robb, Michael A, Worth, Graham A, Blancafort San José, Lluís
Year of Publication 2008
Get more information
Year of Publication 2008
Journal Article