Pseudopotential-Based Correlation Consistent Composite Approach (rp-ccCA) for First- and Second-Row Transition Metal Thermochemistry

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This article uses the relativistic-pseudopotential correlation consistent approach (rp-ccCA) to determine the enthalpy of formation of 24 first row (3d) transition metal compounds.

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8 p.

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Manivasagam, Sindhu; Laury, Marie L. & Wilson, Angela K. May 22, 2015.

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This article is part of the collection entitled: UNT Scholarly Works and was provided by UNT College of Arts and Sciences to Digital Library, a digital repository hosted by the UNT Libraries. It has been viewed 37 times . More information about this article can be viewed below.

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This article uses the relativistic-pseudopotential correlation consistent approach (rp-ccCA) to determine the enthalpy of formation of 24 first row (3d) transition metal compounds.

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8 p.

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  • The Journal of Physical Chemistry A, 2015. Washington, DC: American Chemical Society

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  • Publication Title: The Journal of Physical Chemistry A
  • Volume: 119
  • Pages: 6867-6874

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UNT Scholarly Works

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  • May 22, 2015

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  • Dec. 21, 2016, 11:10 p.m.

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Manivasagam, Sindhu; Laury, Marie L. & Wilson, Angela K. Pseudopotential-Based Correlation Consistent Composite Approach (rp-ccCA) for First- and Second-Row Transition Metal Thermochemistry, article, May 22, 2015; Washington, DC. (digital.library.unt.edu/ark:/67531/metadc944341/: accessed June 20, 2018), University of North Texas Libraries, Digital Library, digital.library.unt.edu; crediting UNT College of Arts and Sciences.