Sangyoub Lee

Sangyoub Lee

Seoul National University

Professor

Department of Chemistry

Research Area

  • #Physics
  • #Statistical physics
  • #Chemistry
  • #Time-dependent density functional theory
  • #Quantum mechanics
  • #Density functional theory
  • #Fredholm integral equation
  • #Theoretical physics
  • #Matrix (mathematics)
  • #Analytic expression

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Related papers to
‘ Physics ‘ : 8

  • Eliminating spin-contamination of spin-flip time dependent density functional theory within linear response formalism by the use of zeroth-order mixed-reference (MR) reduced density matrix.

    2018/09

    3.0 Impact Factor

    16 citations

    Seunghoon Lee, Michael Filatov, Sangyoub Lee, Cheol Ho Choi

    DOI : 10.1063/1.5044202

    • #Physics
    • #Statistical physics
    • #Matrix (mathematics)
    • #Excited state
    • #Density functional theory
    • #Degeneracy (mathematics)
    • #Energy minimization
    • #Atomic orbital
    • #Time-dependent density functional theory
    • #Spin contamination

All papers authored by
‘ Sangyoub Lee ’ : 14

  • Eliminating spin-contamination of spin-flip time dependent density functional theory within linear response formalism by the use of zeroth-order mixed-reference (MR) reduced density matrix.

    2018/09
    JOURNAL OF CHEMICAL PHYSICS

    3.0 Impact Factor

    16 citations

    Seunghoon Lee, Michael Filatov, Sangyoub Lee, Cheol Ho Choi

    DOI : 10.1063/1.5044202

    • #Physics
    • #Statistical physics
    • #Matrix (mathematics)
    • #Excited state
    • #Density functional theory
    • #Degeneracy (mathematics)
    • #Energy minimization
    • #Atomic orbital
    • #Time-dependent density functional theory
    • #Spin contamination

Related papers to
‘ Physics ‘ : 8

  • Eliminating spin-contamination of spin-flip time dependent density functional theory within linear response formalism by the use of zeroth-order mixed-reference (MR) reduced density matrix.

    2018/09
    JOURNAL OF CHEMICAL PHYSICS

    3.0 Impact Factor

    16 citations

    Seunghoon Lee, Michael Filatov, Sangyoub Lee, Cheol Ho Choi

    DOI : 10.1063/1.5044202

    • #Physics
    • #Statistical physics
    • #Matrix (mathematics)
    • #Excited state
    • #Density functional theory
    • #Degeneracy (mathematics)
    • #Energy minimization
    • #Atomic orbital
    • #Time-dependent density functional theory
    • #Spin contamination
  • Transport dynamics of complex fluids

    2019/06
    PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

    9.4 Impact Factor

    9 citations

    Sanggeun Song, Seong Jun Park, Minjung Kim, Jun Soo Kim, Bong June Sung, Sangyoub Lee, Ji-Hyun Kim, Jaeyoung Sung

    DOI : 10.1073/PNAS.1900239116

    • #Physics
    • #Statistical physics
    • #Stochastic process
    • #Autocorrelation
    • #Convection-diffusion equation
    • #Function (mathematics)
    • #Displacement (vector)
    • #Distribution (mathematics)
    • #Complex fluid
    • #Work (thermodynamics)

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Contact information

Log in

All papers authored by
‘ Sangyoub Lee ’ : 14

  • Eliminating spin-contamination of spin-flip time dependent density functional theory within linear response formalism by the use of zeroth-order mixed-reference (MR) reduced density matrix.

    2018/09
    JOURNAL OF CHEMICAL PHYSICS

    3.0 Impact Factor

    16 citations

    Seunghoon Lee, Michael Filatov, Sangyoub Lee, Cheol Ho Choi

    DOI : 10.1063/1.5044202

    • #Physics
    • #Statistical physics
    • #Matrix (mathematics)
    • #Excited state
    • #Density functional theory
    • #Degeneracy (mathematics)
    • #Energy minimization
    • #Atomic orbital
    • #Time-dependent density functional theory
    • #Spin contamination
  • Efficient implementations of analytic energy gradient for mixed-reference spin-flip time-dependent density functional theory (MRSF-TDDFT)

    2019/05
    JOURNAL OF CHEMICAL PHYSICS

    3.0 Impact Factor

    9 citations

    Seunghoon Lee, Emma Eunji Kim, Hiroya Nakata, Sangyoub Lee, Cheol Ho Choi

    DOI : 10.1063/1.5086895

    • #Physics
    • #Quantum mechanics
    • #Matrix (mathematics)
    • #Density functional theory
    • #Molecular dynamics
    • #Singlet state
    • #Triplet state
    • #Time-dependent density functional theory
    • #Spin-flip
    • #Conical intersection

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