Sang Soo Han

Overview

Best Publications

• Covalent organic frameworks as exceptional hydrogen storage materials.

  Sang Soo Han;Hiroyasu Furukawa;Omar M. Yaghi;William A. Goddard

  996
  Citations

• Recent advances on simulation and theory of hydrogen storage in metal–organic frameworks and covalent organic frameworks

  Sang Soo Han;José L. Mendoza-Cortés;William A. Goddard

  650
  Citations

• Doped metal organic frameworks for reversible H2 storage at ambient temperature

  William A. Goddard;Sang Soo Han

  528
  Citations

• Improved Designs of Metal–Organic Frameworks for Hydrogen Storage

  Sang Soo Han;Wei-Qiao Deng;Wei-Qiao Deng;William A. Goddard

  302
  Citations

• Adsorption Mechanism and Uptake of Methane in Covalent Organic Frameworks: Theory and Experiment

  Joseé L Mendoza-Cortés;Sang Soo Han;Hiroyasu Furukawa;Omar M Yaghi

  224
  Citations

• Metal−Organic Frameworks Provide Large Negative Thermal Expansion Behavior

  Sang Soo Han;William A. Goddard

  222
  Citations

• Molecular dynamics simulations of stability of metal–organic frameworks against H2O using the ReaxFF reactive force field

  Sang Soo Han;Seung Hoon Choi;Adri C.T. Van Duin

  191
  Citations

• ADSORPTION PROPERTIES OF HYDROGEN ON (10, 0) SINGLE-WALLED CARBON NANOTUBE THROUGH DENSITY FUNCTIONAL THEORY

  Sang Soo Han;Hyuck Mo Lee

  186
  Citations

• Exceptional CO2 working capacity in a heterodiamine-grafted metal–organic framework

  Woo Ram Lee;Hyuna Jo;Li Ming Yang;Hanyeong Lee

  162
  Citations

• Unraveling the Atomistic Sodiation Mechanism of Black Phosphorus for Sodium Ion Batteries by First-Principles Calculations

  K. P. S. S. Hembram;Hyun Jung;Byung Chul Yeo;Sung Jin Pai

  160
  Citations

• Tuning Electronic and magnetic properties of phosphorene by vacancies and adatoms

  Pooja Srivastava;K.P.S.S. Hembram;Hiroshi Mizuseki;Kwang-Ryeol Lee

  156
  Citations

• Tuning Metal-Organic Frameworks with Open-Metal Sites and Its Origin for Enhancing CO2 Affinity by Metal Substitution.

  Joonho Park;Heejin Kim;Sang Soo Han;Yousung Jung

  152
  Citations

• Boron doped defective graphene as a potential anode material for Li-ion batteries

  Rahul P. Hardikar;Deya Das;Sang Soo Han;Kwang-Ryeol Lee

  141
  Citations

• ReaxFF Reactive Force Field for the Y-Doped BaZrO3 Proton Conductor with Applications to Diffusion Rates for Multigranular Systems

  Adri C. T. van Duin;Boris V. Merinov;Sang Soo Han;Claudio O. Dorso

  136
  Citations

• Facile control of defect site density and particle size of UiO-66 for enhanced hydrolysis rates: insights into feasibility of Zr(IV)-based metal-organic framework (MOF) catalysts

  Kie Yong Cho;Kie Yong Cho;Jin Young Seo;Hyun Ji Kim;Sung Jin Pai

  134
  Citations

• Optimization and application of lithium parameters for the reactive force field, ReaxFF.

  Sang Soo Han;Adri C. T. van Duin;William A. Goddard;Hyuck Mo Lee

  120
  Citations

• Simultaneously Controllable Doping Sites and the Activity of a W–N Codoped TiO2 Photocatalyst

  Heechae Choi;Dongbin Shin;Byung Chul Yeo;Taeseup Song

  105
  Citations

• Band Gap Engineering of Paradigm MOF-5

  Li Ming Yang;Li Ming Yang;Guo Yong Fang;Jing Ma;Eric Ganz

  105
  Citations

• Reaction Mechanism of Area-Selective Atomic Layer Deposition for Al2O3 Nanopatterns.

  Seunggi Seo;Byung Chul Yeo;Sang Soo Han;Chang Mo Yoon

  105
  Citations

• High H2 uptake in Li-, Na-, K-metalated covalent organic frameworks and metal organic frameworks at 298 K.

  José L. Mendoza-Cortés;Sang Soo Han;William A. Goddard

  100
  Citations

• High H2 Storage of Hexagonal Metal−Organic Frameworks from First-Principles-Based Grand Canonical Monte Carlo Simulations

  Sang Soo Han;William A. Goddard

  93
  Citations