Approaching chemical accuracy with density functional calculations: Diatomic energy corrections

Grindy, Scott; Meredig, Bryce; Kirklin, Scott; Saal, James E.; Wolverton, C.

doi:10.1103/PhysRevB.87.075150

Title: Approaching chemical accuracy with density functional calculations: Diatomic energy corrections

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Authors:: Grindy, Scott; Meredig, Bryce; Kirklin, Scott; Saal, James E.; Wolverton, C.

Publication Date:: Thu Feb 28 00:00:00 EST 2013

Sponsoring Org.:: USDOE

OSTI Identifier:: 1102367

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Physical Review B

Additional Journal Information:: Journal Volume: 87; Journal Issue: 7; Journal ID: ISSN 1098-0121

Publisher:: American Physical Society

Country of Publication:: United States

Language:: English

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                    Grindy, Scott, Meredig, Bryce, Kirklin, Scott, Saal, James E., and Wolverton, C. Approaching chemical accuracy with density functional calculations: Diatomic energy corrections.  United States: N. p., 2013. 
Web.  doi:10.1103/PhysRevB.87.075150.

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                    Grindy, Scott, Meredig, Bryce, Kirklin, Scott, Saal, James E., & Wolverton, C. Approaching chemical accuracy with density functional calculations: Diatomic energy corrections.  United States.  https://doi.org/10.1103/PhysRevB.87.075150

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                    Grindy, Scott, Meredig, Bryce, Kirklin, Scott, Saal, James E., and Wolverton, C. Thu .  
"Approaching chemical accuracy with density functional calculations: Diatomic energy corrections".  United States.  https://doi.org/10.1103/PhysRevB.87.075150.

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@article{osti_1102367,

  title        = {Approaching chemical accuracy with density functional calculations: Diatomic energy corrections},

  author       = {Grindy, Scott and Meredig, Bryce and Kirklin, Scott and Saal, James E. and Wolverton, C.},

  abstractNote = {},

  doi          = {10.1103/PhysRevB.87.075150},

  journal      = {Physical Review B},

  number       = 7,

  volume       = 87,

  place        = {United States},

  year         = {Thu Feb 28 00:00:00 EST 2013},

  month        = {Thu Feb 28 00:00:00 EST 2013}

}

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