2019

147. 10^th Biennial International Conference of The Asian Consortium on Computational Materials Science (ACCMS-10) conference, Hong Kong (2019)
     CHARACTERIZATION OF TWO-DIMENSIONAL ULTRATHIN OXIDES ON METAL SUBSTRATES: A THEORETICAL SURFACE SCIENCE CONTEXT
     T. Lee, Y.-J. Lee, K. Palotás, and A. Soon (Invited)
146. Korean Ceramic Society Spring Meeting, Jeju, South Korea (2019)
     POLYMORPHIC EXPRESSIONS OF SUPPORTED LOW-DIMENSIONAL MoO_x ON Au(111)
     T. Lee, Y.-J. Lee, G. Lee, and A. Soon (Invited)
145. Korean Ceramic Society Spring Meeting, Jeju, South Korea (2019)
     CHEMICAL BONDING AND ELECTRONIC STRUCTURE ANALYSIS OF LAYERED HEXAGONAL ZnIn₂S₄
     J. Lee, T. Lee, W. Jang, and A. Soon
144. Korean Ceramic Society Spring Meeting, Jeju, South Korea (2019)
     DOPING, DEFECTS, AND DISORDER: EXAMINING THE ELECTRONIC STRUCTURE OF QUINTERNARY OXYSULFIDE (Ba,Ca)ZnOS FROM FIRST-PRINCIPLES
     W. Hwang and A. Soon
143. Deutschen Physikalischen Gesellschaft (DPG) Spring Meeting of the Condensed Matter Section (SKM), Regensburg, Germany (2019)
     POLYMORPHIC EXPRESSIONS OF ULTRATHIN OXIDIC LAYERS OF Mo ON Au(111)
     T. Lee, Y.-J. Lee, K. Palotás, G. Lee, C. Stampfl, and A. Soon
142. Deutschen Physikalischen Gesellschaft (DPG) Spring Meeting of the Condensed Matter Section (SKM), Regensburg, Germany (2019)
     REVISITING THE O/Cu(111) SYSTEM (AGAIN): LOOKING THROUGH THE LENS OF THEORETICAL SURFACE SPECTROSCOPY AND MICROSCOPY
     T. Lee, Y.-J. Lee, G. Lee, K. Palotás, and A. Soon
141. Deutschen Physikalischen Gesellschaft (DPG) Spring Meeting of the Condensed Matter Section (SKM), Regensburg, Germany (2019)
     TWO-DIMENSIONAL CuI ON Cu(111): A FIRST-PRINCIPLES INVESTIGATION
     G. Lee, T. Lee, and A. Soon
140. Deutschen Physikalischen Gesellschaft (DPG) Spring Meeting of the Condensed Matter Section (SKM), Regensburg, Germany (2019)
     MIXING THERMODYNAMICS OF MoO₃-WO₃ SOLID SOLUTIONS FROM FIRST-PRINCIPLES CALCULATIONS
     J. Yun, R. Grau-Crespo, and A. Soon
139. Deutschen Physikalischen Gesellschaft (DPG) Spring Meeting of the Condensed Matter Section (SKM), Regensburg, Germany (2019)
     DESIGNING NEW TWO-DIMENSIONAL JANUS NANOMATERIALS BY ANIONIC EXCHANGE
     W. Jang and A. Soon
138. Electronic Materials and Applications 2019 (EMA 2019) Conference, Orlando, FL, USA (2019)
     AB INITIO THERMODYNAMICS OF COMPLEX SURFACE OXIDES UNDER CONTROLLED GROWTH CONDITIONS
     A. Soon (Invited)
137. Electronic Materials and Applications 2019 (EMA 2019) Conference, Orlando, FL, USA (2019)
     EXPISCATING THE ACCURATE ATOMIC STRUCTURE OF COMPLEX SURFACE OXIDES ON Cu(111): A FIRST-PRINCIPLES INVESTIGATION
     Y.-J. Lee, T. Lee and A. Soon
136. Electronic Materials and Applications 2019 (EMA 2019) Conference, Orlando, FL, USA (2019)
     CHEMICAL BONDING AND ELECTRONIC STRUCTURE ANALYSIS OF LAYERED HEXAGONAL ZnIn₂S₄
     J. Lee, T. Lee, W. Jang and A. Soon

2018

135. International Symposium on Ab Initio Electron Dynamics Simulations, Tsukuba, Japan (2018)
     INTERFACE EFFECTS ON THE IONIC CONDUCTIVITY OF DOPED CERIA-YTTRIA-STABILIZED ZIRCONIA HETEROINTERFACE
     M. E. Kilic and A. Soon
134. Korean Physical Society (KPS) Fall Meeting, Changwon, South Korea (2018)
     THE GENESIS OF OXIDATION ON METALS: A THEORETICAL SURFACE SCIENCE APPROACH
     A. Soon (Invited)
133. Korean Physical Society (KPS) Fall Meeting, Changwon, South Korea (2018)
     SYSTEMATIC CHARACTERIZATION OF METAL-SUPPORTED ULTRATHIN COPPER OXIDE LAYERS FROM FIRST-PRINCIPLES CALCULATIONS
     T. Lee, Y. Lee, K. Palotás, and A. Soon
132. Korean Physical Society (KPS) Fall Meeting, Changwon, South Korea (2018)
     OVER-STOICHIOMETRY IN HEAVY METAL OXIDES: THE CASE OF IONO-COVALENT TANTALUM TRIOXIDES
     Y.-J. Lee, T. Lee, and A. Soon
131. Emerging Technologies in Mechanical Engineering (ETME), Jeju, South Korea (2018)
     REDUCTION IN PHONON GROUP VELOCITY IN NANOFILMS
     H. Kim, M. E. Kilic, A. Soon, and W. Kim
130. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     INFLUENCE OF Rb/Cs CATION-EXCHANGE ON INORGANIC Sn HALIDE PEROVSKITES: FROM CHEMICAL STRUCTURE TO PHYSICAL PROPERTIES
     Y.-K. Jung, J.-H. Lee, A. Walsh, and A. Soon
129. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     SYSTEMATIC CHARACTERIZATION OF METAL-SUPPORTED ULTRATHIN COPPER OXIDE LAYERS FROM FIRST-PRINCIPLES CALCULATIONS
     T. Lee, Y. Lee, B. Lee, K. Palotás, and A. Soon
128. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     AB INITIO THERMODYNAMICS OF SURFACE OXIDE STRUCTURES UNDER CONTROLLED GROWTH CONDITIONS
     T. Lee, Y. Lee, S. Piccinin, and A. Soon
127. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     REMARKABLY LOW-ENERGY ONE-DIMENSIONAL FAULT LINE DEFECTS IN SINGLE-LAYERED PHOSPHORENE
     W. Jang, K. Kang, and A. Soon
126. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     UNRAVELING THE INTERCALATION CHEMISTRY OF HEXAGONAL TUNGSTEN BRONZE AND ITS OPTICAL RESPONSES
     Y. Lee, T. Lee, W. Jang, and A. Soon
125. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     AB INITIO SURFACE PHASE DIAGRAM OF Sn/Cu(100): RECONCILING EXPERIMENTS WITH THEORY
     J.-H. Lee, J. Yun, T. Lee, and A. Soon
124. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     ALIGNING THE BAND STRUCTURES OF POLYMORPHIC MOLYBDENUM OXIDES AND ORGANIC EMITTERS IN LIGHT-EMITTING DIODES
     J. Yun, W. Jang, T. Lee, Y. Lee, and A. Soon
123. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     EXPLORING ENVIRONMENT-DEPENDENT SHAPE EVOLUTION IN M₂X₃ NANO-CRYSTALLITES: A FIRST-PRINCIPLES THERMODYNAMICS APPROACH
     J. Lee and A. Soon
122. International Union of Materials Research Societies – International Conference on Electronic Materials 2018 (IUMRS-ICEM 2018), Daejeon, South Korea (2018)
     CHEMICAL TRANSFORMATION OF METALS AND CHALCOGENS: AN EXPERIMENTAL AND THEORETICAL INVESTIGATION
     J. Lee, G. Park, S. Moon, H. Yang, A. Giri, J. Kwak, Y.-K. Jung, U. Jeong, and A. Soon
121. ACCMS-PRO Satellite Meeting, NANO KOREA 2018, KINTEX Seoul, South Korea (2018)
     AB INITIO THERMODYNAMICS OF SURFACE OXIDE STRUCTURES UNDER CONTROLLED GROWTH CONDITIONS
     T. Lee, Y. Lee, S. Piccinin, and A. Soon (Invited)
120. International Conference on Theoretical Aspects of Catalysis 17 (ICTAC 17), Los Angeles, CA, USA (2018)
     SYSTEMATIC CHARACTERIZATION OF METAL-SUPPORTED ULTRATHIN COPPER OXIDE LAYERS FROM FIRST-PRINCIPLES CALCULATIONS
     T. Lee, Y. Lee, B. Lee, K. Palotás, and A. Soon
119. 16^th Workshop on First-Principles Computational Materials Physics, Hsinchu, Taiwan (2018)
     COMPOSITION-DEPENDENT PHASE STABILITY IN YTTRIA STABILIZED ZIRCONIA
     J. Yun, M. E. Kilic, and A. Soon
118. 16^th Workshop on First-Principles Computational Materials Physics, Hsinchu, Taiwan (2018)
     AB INITIO THERMODYNAMICS OF SURFACE OXIDE STRUCTURES UNDER CONTROLLED GROWTH CONDITIONS
     T. Lee, Y. Lee, and A. Soon (Invited)
117. Quantum Espresso Workshop, Penn State University, PA, USA (2018)
     LATTICE DYNAMICS OF POLYMORPHIC ZnIn₂S₄: AN AB INITIO STUDY
     J. Lee, W. Jang, T. Lee, and A. Soon
116. Materials Research Society (MRS) Spring Meeting, Phoenix, AZ, USA (2018)
     ION DIFFUSION OF YTTRIA-SCANDIA STABILIZED ZIRCONIA HETEROGENEOUS INTERFACES
     M. E. Kilic and A. Soon
115. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     AB INITIO THERMODYNAMICS OF SURFACE OXIDE STRUCTURES UNDER CONTROLLED GROWTH CONDITIONS
     T. Lee, Y. Lee, S. Piccinin, and A. Soon
114. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     DESIGNING NEW TWO-DIMENSIONAL JANUS NANOMATERIALS BY ANIONIC EXCHANGE
     W. Jang and A. Soon
113. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     INTERFACE ENGINEERING OF ULTRATHIN COPPER OXIDES LAYERS ON Cu-DOPED Au SURFACES FROM FIRST-PRINCIPLES CALCULATIONS
     T. Lee, Y. Lee, S. Piccinin, and A. Soon
112. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     COMPOSITION-DEPENDENT PHASE STABILITY IN YTTRIA STABILIZED ZIRCONIA: CLUES FROM LATTICE DYNAMICS CALCULATION
     J. Yun, J.-H. Lee, M. E. Kilic, and A. Soon
111. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     EXPLORING ENVIRONMENT-DEPENDENT SHAPE EVOLUTION IN Bi₂Se₃ NANO-CRYSTALLITES: A FIRST-PRINCIPLES THERMODYNAMICS APPROACH
     J. Lee and A. Soon
110. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     EXPLORING POLYMORPHISM IN HIGH-VALENT TANTALUM TRIOXIDES
     Y. Lee, U. Kim, Y. Lee, T. Lee, and A. Soon
109. American Physical Society (APS) March Meeting, Los Angeles, CA, USA (2018)
     LATTICE DYNAMICS OF POLYMORPHIC ZnIn₂S₄: AN AB INITIO STUDY
     J. Lee, W. Jang, T. Lee, and A. Soon

2017

108. 4^th International Conference on Advanced Electromaterials (ICAE 2017), Jeju, South Korea (2017)
     PLAYING WITH PHOSPHORENE ORIGAMI: FROM REMARKABLY LOW-ENERGY LINE DEFECTS TO TWISTED NANORIBBONS
     W. Jang, K. Kang, and A. Soon (Invited)
107. Korean Ceramic Society Fall Meeting, COEX Seoul, South Korea (2017)
     EXPLORING POLYMORPHISM IN HIGH-VALENT TANTALUM TRIOXIDES
     Y. Lee, U. Kim, Y. Lee, T. Lee, and A. Soon
106. Korean Ceramic Society Fall Meeting, COEX Seoul, South Korea (2017)
     ALIGNING THE BAND STRUCTURES OF POLYMORPHIC MOLYBDENUM OXIDES AND ORGANIC EMITTERS IN LIGHT-EMITTING DIODES
     J. Yun, W. Jang, T. Lee, Y. Lee, and A. Soon
105. Korean Ceramic Society Fall Meeting, COEX Seoul, South Korea (2017)
     ASSEMBLING PHOSPHORENE FLEXAGONS FOR 2D ELECTRON-DENSITY-GUIDED NANOPATTERNING AND NANOFABRICATION
     W. Jang, K. Kang, and A. Soon
104. 15^th International Nanotech Symposium & Nano-Convergence Expo (NANO KOREA 2017), KINTEX, Ilsan, South Korea (2017)
     EXPLORING THE SCIENCE (AND THE ART) OF PHOSPHORENE KIRIGAMI
     W. Jang, K. Kang, and A. Soon (Invited)
103. 15^th International Nanotech Symposium & Nano-Convergence Expo (NANO KOREA 2017), KINTEX, Ilsan, South Korea (2017)
     THE INFLUENCE OF CATION EXCHANGE IN INORGANIC LEAD-FREE HALIDE PEROVSKITE: AN AB INITIO STUDY
     J.-H. Lee, Y.-K. Jung, A. Walsh, and A. Soon
102. 15^th International Nanotech Symposium & Nano-Convergence Expo (NANO KOREA 2017), KINTEX, Ilsan, South Korea (2017)
     FIRST-PRINCIPLES THERMODYNAMICS OF THIN OXIDE STRUCTURES ON METAL SUPPORT UNDER CONTROLLED GROWTH CONDITIONS
     T. Lee, Y. Lee, S. Piccinin, and A. Soon
101. 15^th International Nanotech Symposium & Nano-Convergence Expo (NANO KOREA 2017), KINTEX, Ilsan, South Korea (2017)
     CHEMICAL TRANSFORMATION OF METALS AND CHALCOGENS: AN EXPERIMENTAL AND THEORETICAL INVESTIGATION
     J. Lee, G. Park, S. Moon, H. Yang, A. Giri, J. Kwak, Y.-K. Jung, U. Jeong, and A. Soon
100. 15^th International Nanotech Symposium & Nano-Convergence Expo (NANO KOREA 2017), KINTEX, Ilsan, South Korea (2017)
     THE ROLE OF POLYMORPHISM IN MOLYBDENUM TRIOXIDES FOR LIGHT-EMITTING DIODE APPLICATIONS
     J.-M. Yun, W. Jang, T. Lee, Y. Lee, and A. Soon
99. 25^th North American Catalysis Society Meeting (NAM), Denver, CO, USA (2017)
    MORPHOLOGICAL CHANGES OF CATALYST MATERIALS IN REACTING CONDITIONS BY COMBINED AB-INITIO THERMODYNAMICS AND MICROKINETIC MODELING
    R. Cheula, A. Soon, and M. Maestri
98. Electronic Materials and Applications (EMA 2017) Conference (SYMPOSIUM 4: Computational Design of Electronic Materials), Orlando, FL, USA (2017)
    A FIRST-PRINCIPLES UNDERSTANDING OF THE STRUCTURE-PROPERTY RELATIONSHIPS IN POLYMORPHIC MoO₃
    J.-M. Yun, W. Jang, T. Lee, Y. Lee, and A. Soon
97. Electronic Materials and Applications (EMA 2017) Conference (SYMPOSIUM 4: Computational Design of Electronic Materials), Orlando, FL, USA (2017)
    UNDERSTANDING THE ADVANTAGES OF HEXAGONAL WO₃ AS AN EFFICIENT PHOTOANODE FOR SOLAR WATER SPLITTING: A FIRST-PRINCIPLES PERSPECTIVE
    T. Lee, Y. Lee, W. Jang, and A. Soon (Invited)

2016

96. Korean Ceramic Society Fall Meeting, COEX Seoul, South Korea (2016)
    PHOSPHORENE UNDERGOES A LITTLE "NIP-AND-TUCK": FROM REMARKABLY LOW-ENERGY LINE DEFECTS TO TWISTED NANORIBBONS
    A. Soon (Invited)
95. International Conference on Electronic Materials and Nanotechnology for Green Environment 2016 (ENGE 2016), Jeju, South Korea (2016)
    TUNING THE CHEMICAL POTENTIAL OF NON-EQUILIBRIUM SURFACE SYSTEMS: THE O/Cu/Au CASE
    T. Lee, Y. Lee, S. Piccinin, and A. Soon
94. The Korean Institute of Metals and Materials (KIM) Fall Meeting, Busan, Korea (2016)
    CO-ADSORPTION OF Cl AND OOH SPECIES ON Pt/TiX CATALYSIS SYSTEM: AN AB INITIO STUDY
    Y.-J. Tak and A. Soon
93. Energy Materials Nanotechnology (EMN) Meeting on Computation and Theory, Las Vegas, NV, USA (2016)
    IN SEARCH OF UNCONVENTIONAL ULTRATHIN METASTABLE O/Cu SURFACE OXIDES
    A. Soon (Invited)
92. Energy Materials Nanotechnology (EMN) Meeting on Computation and Theory, Las Vegas, NV, USA (2016)
    UNDERSTANDING THE ADVANTAGE OF HEXAGONAL WO₃ AS AN EFFICIENT PHOTOANODE FOR SOLAR WATER SPLITTING: A FIRST-PRINCIPLES PERSPECTIVE
    Y. Lee, T. Lee, W. Jang, and A. Soon
91. Energy Materials Nanotechnology (EMN) Meeting on Computation and Theory, Las Vegas, NV, USA (2016)
    ACUTE MECHANO-ELECTRONIC RESPONSES IN TWISTED PHOSPHORENE NANORIBBONS
    W. Jang, K. Kang, and A. Soon
90. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    REMARKABLY LOW-ENERGY ONE-DIMENSIONAL FAULT LINE DEFECTS IN SINGLE-LAYERED PHOSPHORENE
    W. Jang, K. Kang, and A. Soon
89. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    OXIDIC COPPER ON THE Au(111) SURFACE: A THEORETICAL SURFACE SCIENCE APPROACH
    T. Lee, Y. Lee, and A. Soon
88. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    INFLUENCE OF XC FUNCTIONAL ON THERMAL-ELASTIC PROPERTIES OF CERIA: A DFT-BASED DEBYE-GRÜNEISEN MODEL APPROACH
    J.-H. Lee, Y.-J. Tak, T. Lee, and A. Soon
87. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    TWISTED PHOSPHORENE NANORIBBONS
    W. Jang, K. Kang, and A. Soon
86. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    A DFT STUDY OF METASTABLE h-WO₃ SURFACES
    Y. Lee, T. Lee, W. Jang, and A. Soon
85. American Physical Society (APS) March Meeting, Baltimore, MA, USA (2016)
    MICROFACETING OF Cu₂O AND ITS IMPLICATIONS IN PHOTOCHEMISTRY
    T. Lee, Y. Lee, Y. Lee, and A. Soon

2015

84. Materials Research Society (MRS) Fall Meeting, Boston, MA, USA (2015)
    LOW-ENERGY ONE-DIMENSIONAL LINE DEFECTS IN SINGLE-LAYERED PHOSPHORENE: A FIRST-PRINCIPLES STUDY
    W. Jang, K. Kang, and A. Soon
83. Materials Research Society (MRS) Fall Meeting, Boston, MA, USA (2015)
    SURFACE OXIDE EFFECT ON THE ADSORPTION OF PMDA-ODA ON Cu(111)
    J.-H Park, J.-H Lee, and A. Soon
82. 5^th Psi-k (Ψk-2015) Conference, San Sebastian, Spain (2015)
    INFLUENCE OF xc-FUNCTIONALS ON THE OPTO-ELECTRONIC PROPERTIES OF WO₃ POLYMORPHS
    Y.-H. Lee, T.-H. Lee, W. Jang, and A. Soon
81. 5^th Psi-k (Ψk-2015) Conference, San Sebastian, Spain (2015)
    LOW-ENERGY ONE-DIMENSIONAL LINE DEFECTS IN SINGLE-LAYERED PHOSPHORENE: A FIRST-PRINCIPLES STUDY
    W. Jang, K. Kang, and A. Soon
80. 5^th Psi-k (Ψk-2015) Conference, San Sebastian, Spain (2015)
    A FIRST-PRINCIPLES INVESTIGATION OF Sn/Cu(001)
    J.-M. Yun, J.-H. Lee, and A. Soon
79. 5^th Psi-k (Ψk-2015) Conference, San Sebastian, Spain (2015)
    OXYGEN ELECTROCATALYSIS ON SINGLE-ATOM Pt/TiN NANOCATALYST
    Y.-J. Tak, D.-H. Lim, and A. Soon
78. Korean Institute of Chemical Engineering (KIChE) 28^th Symposium on Catalysis Research (Theme: Nanocatalyst and Computational Chemistry), Yeosu, Korea (2015)
    A RATIONAL DESIGN OF SINGLE-ATOM OXYGEN REDUCTION REACTION CATALYSTS USING NON-CONVENTIONAL SUPPORTS
    A. Soon (Invited)
77. Korean Institute of Chemical Engineering (KIChE) 28^th Symposium on Catalysis Research (Theme: Nanocatalyst and Computational Chemistry), Yeosu, Korea (2015)
    OXYGEN ADSORPTION AND STABILITY OF COPPER SURFACE OXIDES ON Au(111): A FIRST-PRINCIPLES INVESTIGATION
    T.-H. Lee, K.-S. Kang, J.-H. Park, and A. Soon
76. Korean Institute of Chemical Engineering (KIChE) 28^th Symposium on Catalysis Research (Theme: Nanocatalyst and Computational Chemistry), Yeosu, Korea (2015)
    BULK PROPERTIES OF BULK METALS: A VAN DER WAALS CORRECTED DFT STUDY
    J.-H. Lee, J.-H. Lim, and A. Soon
75. The 8^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-8), Taipei, Taiwan (2015)
    NON-CONVENTIONAL SUPPORTS FOR SINGLE-ATOM NANOCATALYSTS FOR THE OXYGEN REDUCTION REACTION
    A. Soon (Invited)
74. The 8^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-8), Taipei, Taiwan (2015)
    INFLUENCE OF NON-LOCAL VAN DER WAALS CORRECTIONS ON THE BULK AND SURFACE PROPERTIES OF PRISTINE METALS
    J.-H. Lee, J.-H. Lim, and A. Soon
73. The 8^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-8), Taipei, Taiwan (2015)
    A DENSITY-FUNCTIONAL THEORY STUDY OF THE OPTO-ELECTRONIC PROPERTIES OF POLYMORPHIC WO₃
    T.-H. Lee, Y.-H. Lee, W. Jang, and A. Soon
72. The 8^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-8), Taipei, Taiwan (2015)
    A FIRST-PRINCIPLES STUDY OF THE MECHNO-THERMODYNAMICS OF SUPER-ULTRAHARD MATERIALS
    Y.-H. Lee, J.-H. Lee, and A. Soon
71. American Physical Society (APS) March Meeting, San Antonio, TX, USA (2015)
    RE-VISITING THE O/Cu SYSTEM - WHEN METASTABLE SURFACE OXIDES COULD BECOME AN ISSUE!
    N. Richter, C.-E. Kim, C. Stampfl, and A. Soon
70. American Physical Society (APS) March Meeting, San Antonio, TX, USA (2015)
    ELECTRONIC AND OPTICAL PROPERTIES OF ULTRATHIN SILICON NANOMEMBRANES: A FIRST-PRINCIPLES INVESTIGATION
    W.-S. Jang, S.-H. Yoo, and A. Soon
69. American Physical Society (APS) March Meeting, San Antonio, TX, USA (2015)
    INFLUENCE OF VAN DER WAALS CORRECTED XC-FUNCTIONALS ON THE ANISOTROPIC MECHANICAL PROPERTIES OF COINAGE METALS: A FIRST-PRINCIPLES APPROACH
    J.-H. Lee, J.-H. Park, Y.-K. Jung, and A. Soon
68. American Physical Society (APS) March Meeting, San Antonio, TX, USA (2015)
    A DFT STUDY OF OXYGEN REDUCTION REACTION ON SINGLE-ATOM PT NANOCATALYST
    Y.-J. Tak, N. Richter, and A. Soon

2014

67. Conference on Electronic Materials and Nanotechnology for Green Environment 2014 (ENGE2014), Jeju, Korea (2014)
    RE-VISITING THE O/Cu SYSTEM - WHEN METASTABLE SURFACE OXIDES COULD BECOME AN ISSUE!
    N. Richter, C.-E. Kim, and A. Soon (Invited)
66. Conference on Electronic Materials and Nanotechnology for Green Environment 2014 (ENGE2014), Jeju, Korea (2014)
    ELECTRONIC AND OPTICAL PROPERTIES OF ULTRATHIN SILICON NANOMEMBRANES: A FIRST-PRINCIPLES INVESTIGATION
    W.-S. Jang, S.-H. Yoo, and A. Soon
65. Conference on Electronic Materials and Nanotechnology for Green Environment 2014 (ENGE2014), Jeju, Korea (2014)
    A FIRST-PRINCIPLES DESCRIPTION OF SURFACE STRESS RESPONSES IN NANO-ELECTROCATALYSTS
    J.-H. Lee, S.-H. Yoo, and A. Soon
64. Conference on Electronic Materials and Nanotechnology for Green Environment 2014 (ENGE2014), Jeju, Korea (2014)
    AB INITIO THERMODYNAMICS OF Pt NANOSKINS ON TiN(100) FOR FUEL CELL TECHNOLOGIES
    Y.-J. Tak, N. Richter, and A. Soon
63. 3^rd International Symposium on Hybrid Materials and Processing (HyMaP 2014), Busan, Korea (2014)
    LATTICE-MISMATCHED HETEROEPITAXY OF IV-VI THIN FILMS ON PbTe(001): AN AB INITIO STUDY
    C.-E. Kim, Y.-J. Tak, K. T. Butler, A. Walsh, and A. Soon (Invited)
62. 3^rd International Symposium on Hybrid Materials and Processing (HyMaP 2014), Busan, Korea (2014)
    ULTRATHIN NANOFILMS OF MgO-SUPPORTED TiN
    J.-H. Lee, B. Delley, and A. Soon
61. 17^th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-17), Seoul, Korea (2014)
    AB INITIO SURFACE PHASE DIAGRAM OF Sn/Cu(100)
    J.-M. Yun, J.-H. Lee, and A. Soon
60. 17^th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-17), Seoul, Korea (2014)
    ELECTRONIC STRUCTURE AND BAND ALIGNMENT OF ZINC NITRIDE Zn₃N₂
    S.-H. Yoo, A. Walsh, D. O. Scanlon, and A. Soon
59. 17^th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-17), Seoul, Korea (2014)
    AB INITIO THERMODYNAMICS OF Pt NANOSKINS ON TiN(100) FOR FUEL CELL TECHNOLOGIES
    Y.-J. Tak, N. Richter, and A. Soon
58. The Korean Institute of Metals and Materials (KIM) Fall Meeting, Kangwon-Do, Korea (2014)
    ELECTRONIC AND OPTICAL PROPERTIES OF ULTRATHIN SILICON NANOSHEETS: A FIRST-PRINCIPLES INVESTIGATION
    W.-S. Jang, S.-H. Yoo, and A. Soon
57. The Korean Institute of Metals and Materials (KIM) Fall Meeting, Kangwon-Do, Korea (2014)
    AB INITIO STUDY OF THE SURFACE PHASE DIAGRAM OF Sn/Cu(001)
    J.-M. Yun, J.-H. Lee, and A. Soon
56. 3^rd UK-Korea Workshop on Catalysis, The Royal Society, London, UK (2014)
    A bilateral UK-Korea program on catalysis
    A. Soon (Invited)
    

2013

55. The 8^th International Conference on Advanced Materials and Devices (ICAMD 2013), Jeju, Korea (2013)
    WHY BROMINE SQUARES OFF PALLADIUM? AN AB INITIO STUDY OF BROMINATED PALLADIUM AND ITS NANOMORPHOLOGY
    S.-H. Yoo, J.-H. Lee, B. Delley, and A. Soon (Invited)
54. The 8^th International Conference on Advanced Materials and Devices (ICAMD 2013), Jeju, Korea (2013)
    ELECTRONIC STRUCTURE AND BAND ALIGNMENT OF ZINC NITRIDE Zn₃N₂
    S.-H. Yoo, A. Walsh, D. O. Scanlon, and A. Soon
53. Materials Research Society (MRS) Fall Meeting, Boston, MA, USA (2013)
    A FIRST-PRINCIPLES STUDY ON THE CRYSTALLINE AND AMORPHOUS PHASES OF ANTIMONY OXIDE
    C.-E. Kim and A. Soon
52. Electronic Materials and Nanotechnology for Green Environment (ENGE 2013), GwangJu, Korea (2013)
    WHY BROMINE SQUARES OFF PALLADIUM? AN AB INITIO STUDY OF BROMINATED PALLADIUM AND ITS NANOMORPHOLOGY
    S.-H. Yoo, J.-H. Lee, B. Delley, and A. Soon
51. Korean Institute of Metals and Materials (KIMS) Fall Meeting, GwangJu, Korea (2013)
    A FIRST-PRINCIPLES STUDY ON Sb_xO_y CRYSTALLINE AND AMORPHOUS PHASE
    C.-E. Kim , S.-H. Yoo, and A. Soon
50. Korean Institute of Metals and Materials (KIMS) Fall Meeting, GwangJu, Korea (2013)
    ELECTRONIC STRUCTURE AND BAND ALIGNMENT OF ZINC NITRIDE Zn₃N₂
    S.-H. Yoo, A. Walsh, D. O. Scanlon, and A. Soon
49. Korean Ceramic Society Fall Meeting, Jeju, Korea (2013)
    AB INITIO SURFACE PHASE DIAGRAM OF Sn/Cu(001)
    J.-M. Yun, J.-H. Lee, and A. Soon
48. Korean Ceramic Society Fall Meeting, Jeju, Korea (2013)
    ULTRATHIN NANOFILMS OF MgO-SUPPORTED TiN
    J.-H. Lee, B. Delley, and A. Soon
47. Korean Ceramic Society Fall Meeting, Jeju, Korea (2013)
    ELECTRONIC STRUCTURE AND BAND ALIGNMENT OF ZINC NITRIDE, Zn₃N₂
    S.-H. Yoo, A. Walsh, D. O. Scanlon, and A. Soon (Invited)
46. 9^th World Congress of Chemical Engineering (WCCE9), Seoul, Korea (2013)
    MITIGATION OF CO POISONING: THE ROLE OF NON-CONVENTIONAL SUPPORTS FOR SINGLE-ATOM PLATINIUM CATALYSTS IN FUEL CELL TECHNOLOGY
    A. Soon
45. 9^th KIAS Electronic Structure Workshop, Seoul, Korea (2013)
    A FIRST-PRINCIPLES STUDY ON Sb_xO_y POLYMORPHS
    C.-E. Kim and A. Soon
44. Korean Institute of Metals and Materials (KIMS) Spring Meeting, Yeosu, Korea (2013)
    A FIRST-PRINCIPLES STUDY ON Sb_xO_y POLYMORPHS
    C.-E. Kim and A. Soon

2012

43. 2012 International Conference on Renewable Energy and Policy, Taipei, Taiwan (2012)
    A. Soon (Invited Alexander von Humboldt conferee)
42. 15^th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-15), Institute of Atomic and Molecular Sciences, Academia Sinica, Taipei, Taiwan (2012)
    A. Soon, S.-H. Yoo, and J.-H. Lee
41. Korean Institute of Metals and Materials (KIMS) Fall Meeting, KIM-JIM Symposium, Changwon, Korea (2012)
    ENVIRONMENT-DEPENDENT NANOMORPHOLOGY
    A. Soon (Invited)
40. The International Union of Materials Research Societies (IUMRS) -  International Conference on Electronic Materials (ICEM), Yokohama, Japan (2012)
    SURFACE CARBIDIC STRUCTURES ON NICKEL NANOCRYSTALS
    R. Zhao, C. Li, and A. Soon
39. 244^th American Chemical Society (ACS) Fall Meeting, Philadelphia, USA (2012)
    THE ROLE OF NON-CONVENTIONAL SUPPORTS FOR SINGLE-ATOM PLATINUM-BASED CATALYSTS IN FUEL CELL TECHNOLOGY: A THEORETICAL SURFACE SCIENCE APPROACH
    A. Soon, R. Q. Zhang, and C. Stampfl
38. Steel Science Forum, Pohang, Korea (2012)
    THE AUSTENITE/ε-MARTENSITE INTERFACE: A FIRST-PRINCIPLES INVESTIGATION
    S.-J. Lee, Y.-K. Lee, and A. Soon
37. The International Union of Materials Research Societies (IUMRS) - International Conference of Young Researchers on Advanced Materials (ICYRAM), Singapore (2012)
    A. Soon (Invited panelist, Global Materials Network networking session)
36. 8^th KIAS Electronic Structure Workshop, Seoul, Korea (2012)
    MITIGATION OF CO POISONING ON FUNCTIONALIZED Pt₁/TiN SURFACES
    A. Soon (Invited)
35. Korean Ceramic Society Spring Meeting, Daeju, Korea (2012)
    THE ROLE OF NON-CONVENTIONAL CERAMIC SUPPORTS FOR FUEL CELL TECHNOLOGY
    A. Soon (Invited)
34. American Physical Society (APS) March Meeting, Boston, MA, USA (2012)
    INFLUENCE OF XC FUNCTIONAL ON THERMAL-ELASTIC PROPERTIES OF METAL OXIDES: A DFT-BASED DEBYE-GRÜNEISEN MODEL APPROACH
    T.-H. Lee, and A. Soon
33. American Physical Society (APS) March Meeting, Boston, MA, USA (2012)
    THE ROLE OF NON-CONVENTIONAL SUPPORTS FOR SINGLE-ATOM PLATINUM-BASED CATALYSTS IN FUEL CELL TECHNOLOGY: A THEORETICAL SURFACE SCIENCE APPROACH
    R. Q. Zhang, and A. Soon

2011

32. Korean Institute of Metals and Materials (KIMS) Fall Meeting, Daejeon, Korea (2011)
    INFLUENCE OF XC FUNCTIONAL ON THERMAL-ELASTIC PROPERTIES OF CERIA: A DFT-BASED DEBYE-GRÜNEISEN MODEL APPROACH
    T.-H. Lee, R.-Q. Zhang, and A. Soon
31. Korean Institute of Metals and Materials (KIMS) Fall Meeting, Daejeon, Korea (2011)
    SURFACE CARBIDIC STRUCTURES ON Ni(001): A THEORETICAL SURFACE SCIENCE APPROACH
    R.-B. Zhao, C. Li, and A. Soon
30. The 6^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-6), Biopolis, Singapore (2011)
    A FIRST-PRINCIPLES MORPHOLOGICAL STUDY OF TIN NANOCRYSTALLITES: INFLUENCE OF SURFACE DEFECTS AND GROWTH ENVIRONMENT
    T.-H. Lee, B. Delley, C. Stampfl and A. Soon
29. The 6^th Conference of the Asian Consortium on Computational Materials Science (ACCMS-6), Biopolis, Singapore (2011)
    THE ROLE OF NON-CONVENTIONAL SUPPORTS FOR SINGLE-ATOM PLATINUM-BASED CATALYSTS IN FUEL CELL TECHNOLOGY: A THEORETICAL SURFACE SCIENCE APPROACH
    C.-E. Kim, B. Delley, C. Stampfl, and A. Soon (Invited)
28. NANO KOREA 2011, The 9^th International Nanotech Symposium & Exhibition, KINTEX, Korea (2011)
    A FIRST-PRINCIPLES MORPHOLOGICAL STUDY OF TIN NANOCRYSTALLITES: INFLUENCE OF SURFACE DEFECTS AND GROWTH ENVIRONMENT
    T.-H. Lee, B. Delley, C. Stampfl and A. Soon
27. NANO KOREA 2011, The 9^th International Nanotech Symposium & Exhibition, KINTEX, Korea (2011)
    ENVIRONMENT-DEPENDENT MORPHOLOGY OF NANOCRYSTALLITES FROM FIRST-PRINCIPLES
    A. Soon
26. Korean Institute of Metals and Materials (KIMS) Spring Meeting, Korea (2011)
    INTERFACIAL PROPERTIES OF AUSTENITE (111)/ε-MARTENSITE (0001): A FIRST-PRINCIPLES INVESTIGATION
    S.-J. Lee, Y.-K. Lee, and A. Soon
25. The 4^th Cross-Strait Theoretical and Computational Chemistry Conference (CTCC-4), Kinmen, Taiwan (2011)
    NANOPARTICLES SHAPE UP! – FIRST-PRINCIPLES NANOMORPHOLOGY
    A. Soon (Invited)

2010

24. Korean Institute of Metals and Materials (KIMS) Fall Meeting, Changwon, Korea (2010)
    UNDERSTANDING SURFACE NANOSTRUCTURES: AN AB INITIO THERMODYNAMIC APPROACH
    A. Soon (Invited)
23. Korean Institute of Metals and Materials (KIMS) Fall Meeting, Changwon, Korea (2010)
    ULTRATHIN NANOFILMS OF MgO-SUPPORTED TiN: A FIRST-PRINCIPLES INVESTIGATION
    C.-E. Kim, B. Delley, C. Stampfl, and A. Soon
    
22. Korean Institute of Metals and Materials (KIMS) Fall Meeting, Changwon, Korea (2010)
    POLYMORPHIC PHASE STABILITY IN THIN NANOFILMS: AN AB INITIO THERMODYNAMICS CONSIDERATION
    Y.-D. Kim, C. Stampfl, and A. Soon
21. 13^th Asian Workshop on First-Principles Electronic Structure Calculations (Asian13), Pohang, Korea (2010)
    UNDERSTANDING SURFACE NANOSTRUCTURES TO BULK DEFECTS: AN AB INITIO THERMODYNAMIC APPROACH
    A. Soon (Invited)
20. 13^th Asian Workshop on First-Principles Electronic Structure Calculations (Asian13), Pohang, Korea (2010)
    ULTRATHIN NANOFILMS OF MgO-SUPPORTED TiN: A FIRST-PRINCIPLES INVESTIGATION
    C.-E. Kim, B. Delley, C. Stampfl, and A. Soon
19. 13^th Asian Workshop on First-Principles Electronic Structure Calculations (Asian13), Pohang, Korea (2010)
    INTERFACIAL PROPERTIES OF AUSTENITE (111)/ε-MARTENSITE (0001): A FIRST-PRINCIPLES INVESTIGATION
    S.-J. Lee, J. Park, Y.-K. Lee, and A. Soon
18. International Union of Materials Research Societies - International Conference on Electronic Materials 2010 (IUMRS-ICEM2010), Seoul, Korea (2010)
    UNDERSTANDING SURFACE NANOSTRUCTURES TO BULK DEFECTS: AN AB INITIO THERMODYNAMIC APPROACH
    A. Soon
17. 30^th International Conference on the Physics of Semiconductors (ICPS-30), Seoul, Korea (2010)
    UNDERSTANDING CRYSTAL MORPHOLOGY FOR NANOTEMPLATING: A FIRST-PRINCIPLES INVESTIGATION OF THE N/Cu SYSTEM
    A. Soon, B. Delley and C. Stampfl

2009

16. Nanostructures at Surfaces: International Conference, Monte Verita, Ascona, Switzerland (2009)
    BULK AND SURFACE ENERGIES OF TRANSITION METALS IN DENSITY-FUNCTIONAL THEORY AND BEYOND
    A. Soon, M. Fuchs, B. Li and M. Scheffler
15. Catalysis From 1^st Principles (CAT1P), Psi-k Network, Vienna, Austria (2009)
    UNDERSTANDING SURFACE ENERGIES OF TRANSITION METALS IN DENSITY-FUNCTIONAL THEORY AND BEYOND
    A. Soon, M. Fuchs, B. Li and M. Scheffler
14. Deutschen Physikalischen Gesellschaft (DPG) Meeting, Dresden, Germany (2009)
    UNDERSTANDING SURFACE ENERGIES OF TRANSITION METALS WITH DENSITY-FUNCTIONAL THEORY
    A. Soon, M. Fuchs, B. Li and M. Scheffler
13. Deutschen Physikalischen Gesellschaft (DPG) Meeting, Dresden, Germany (2009)
    MULTIFARIOUS-MAGNETISM IN COPPER OXIDE NANOSTRUCTURES FROM FIRST-PRINCIPLES
    A. Soon, X.-Y. Cui, B. Delley, S.-H. Wei and C. Stampfl
12. American Physical Society (APS) March Meeting, Pittsburgh, PA, USA (2009)
    UNDERSTANDING SURFACE ENERGIES OF TRANSITION METALS WITH DENSITY-FUNCTIONAL THEORY
    A. Soon, M. Fuchs, B. Li and M. Scheffler
11. American Physical Society (APS) March Meeting, Pittsburgh, PA, USA (2009)
    MULTIFARIOUS-MAGNETISM IN COPPER OXIDE NANOSTRUCTURES FROM FIRST-PRINCIPLES
    A. Soon, X.-Y. Cui, B. Delley, S.-H. Wei and C. Stampfl

2008

10. 8^th Triennial Congress of the World Association of Theoretical and Computational Chemists, WATOC, Sydney, Australia (2008)
    MULTIFARIOUS-MAGNETISM IN COPPER OXIDE NANOSTRUCTURES FROM FIRST-PRINCIPLES
    A. Soon, X.-Y. Cui, B. Delley, S.-H. Wei and C. Stampfl
9. IUMRS-ICEM: International Conference on Electronic Materials, Sydney, Australia (2008)
   UNDERSTANDING CRYSTAL MORPHOLOGY FOR NANOTEMPLATING: AN AB INITIO THERMODYNAMIC STUDY OF THE N/Cu SYSTEM
   A. Soon, L. Wong, B. Delley and C. Stampfl

2007

8. 14^th WIEN2K Workshop, Singapore (2007)
   AB INITIO SURFACE PHASE DIAGRAM: AN ATTEMPT TO BRIDGE THE "PRESSURE GAP" IN SURFACE SCIENCE
   A. Soon (Selected oral presentation)
   NITROGEN ADSORPTION AND THIN SURFACE NITRIDES ON COPPER SURFACES FROM FIRST-PRINCIPLES
   A. Soon, L. Wong, M. Lee, M. Todorova, B. Delley and C. Stampfl
7. International Conference on Materials for Advanced Technology (ICMAT), Singapore (2007)
   CATALYSIS AT THE SUB-NANO SCALE: CHARACTERIZING THE COPPER-BASED CATALYST FOR THE WATER-GAS SHIFT REACTION
   A. Soon, M. Todorova, B. Delley and C. Stampfl
6. American Physical Society (APS) March Meeting, Denver, CO, USA (2007)
   CHARACTERIZING THE COPPER-BASED CATALYST FOR THE OXYGEN-ASSISTED WATER-GAS SHIFT REACTION AT THE SUB-NANO SCALE
   A. Soon, M. Todorova, B. Delley and C. Stampfl

2006

5. Australian Institute of Physics (AIP): Physics in Industry Day, NSW, Sydney, Australia (2006)
   CATALYSIS AT THE SUB-NANO SCALE: CHARACTERIZING THE COPPER-BASED CATALYST FOR THE WATER-GAS SHIFT REACTION
   A. Soon, M. Todorova, B. Delley and C. Stampfl (Awarded 1^st in the NSW AIP Physics in Industry Student Prize)
4. American Physical Society (APS) March Meeting, Baltimore, MD, USA (2006)
   INVESTIGATING THE FUNCTION OF COPPER-BASED CATALYSTS: THE OXYGEN-COPPER INTERACTION
   A. Soon, M. Todorova, B. Delley and C. Stampfl
3. 30^th Annual Condensed Matter and Materials Meeting, Wagga Wagga, Australia, (2006)
   INVESTIGATING THE FUNCTION OF COPPER-BASED CATALYSTS: THE OXYGEN-COPPER INTERACTION
   A. Soon, M. Todorova, B. Delley and C. Stampfl (Awarded 1^st in the Oral Presentation Student Prize)

2005

2. Psi-K Conference 2005, Schwabisch Gmund, Germany (2005)
   INVESTIGATING THE FUNCTION OF COPPER-BASED CATALYSTS: THE OXYGEN-COPPER INTERACTION
   A. Soon, M. Todorova, B. Delley and C. Stampfl

2004

1. 51^st American Vacuum Society (AVS) International Symposium, Anahiem, CA USA (2004)
   CO COUPLING REACTION ON UO₂ (111) SINGLE CRYSTAL SURFACE: AN EXPERIMENTAL AND THEORETICAL STUDY
   S. D. Senanayake, A. Soon and H. Idriss