Ilgyou Shin

Ilgyou Shin

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Ilgyou Shin

Ilgyou Shin

Publications by authors named "Ilgyou Shin"

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Enhanced von Weizsäcker Wang-Govind-Carter kinetic energy density functional for semiconductors.

J Chem Phys 2014 May;140(18):18A531

Department of Mechanical and Aerospace Engineering, Program in Applied and Computational Mathematics, and Andlinger Center for Energy and the Environment, Princeton University, Princeton, New Jersey 08544-5263, USA.

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http://aip.scitation.org/doi/10.1063/1.4869867
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http://dx.doi.org/10.1063/1.4869867DOI Listing
May 2014

Can orbital-free density functional theory simulate molecules?

J Chem Phys 2012 Feb;136(8):084102

Department of Mechanical and Aerospace Engineering, Princeton University, Princeton, New Jersey 08544, USA.

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http://dx.doi.org/10.1063/1.3685604DOI Listing
February 2012

Structure, stability, thermodynamic properties, and infrared spectra of the protonated water octamer H(+)(H2O)8.

J Phys Chem A 2008 Oct 13;112(41):10120-4. Epub 2008 Sep 13.

Center for Superfunctional Materials, Department of Chemistry, Pohang University of Science and Technology, San 31, Hyojadong, Namgu, Pohang 790-784, Korea.

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http://dx.doi.org/10.1021/jp804806uDOI Listing
October 2008

Eigen and Zundel forms of small protonated water clusters: structures and infrared spectra.

J Phys Chem A 2007 Oct 2;111(42):10692-702. Epub 2007 Oct 2.

Center for Superfunctional Materials, Department of Chemistry, Pohang University of Science and Technology, San 31, Hyojadong, Namgu, Pohang 790-784, Korea.

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http://dx.doi.org/10.1021/jp073912xDOI Listing
October 2007

Structure and spectral features of H+(H2O)7: Eigen versus Zundel forms.

J Chem Phys 2006 Dec;125(23):234305

Center for Superfunctional Materials, Department of Chemistry, Pohang University of Science and Technology, San 31, Hyojadong, Namgu, Pohang 790-784, Korea.

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http://dx.doi.org/10.1063/1.2404659DOI Listing
December 2006