Publications

 

46. Mayank Dodia, Jérémy R. Rouxel, Daeheum Cho, Yu Zhang, Daniel Keefer, Mischa Bonn, Yuki Nagata, and Shaul Mukamel, "Water Solvent Reorganization upon Ultrafast Resonant Stimulated X-ray Raman Excitation of a Metalloporphyrin Dimer”, J. Chem. Theory Comput. 2024 (Accepted).

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45. Jaegyeong Lee, Saira Nayab, Ameet Kumar, Dongil Kim, Hyewon Jung, Sang-Ho Lee, Daeheum Cho+, and Hyosun Lee, "Highly Active Cobalt(II) and Copper(II) Complexes Supported by Aminomethylquinoline Mediating Stereoselective Ring-Opening Polymerization of rac-Lactide”, Bull. Korean Chem. Soc. 2024;1–5.

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44. Hyemi Yeon, Ameet Kumar, Juhwan Song, Juho Lee, Se Jun Wang, Sang Yup Kim, Jinhan Cho, Daeheum Cho+, Tae Ann Kim, "On-demand degradable and acid generating polymers using phenacyl ester derivatives”, Macromolecules 2024, 57(6), 2928–2936.

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43. Ameet Kumar, Sudip Sarkar, Daeheum Cho+, "Chirality and Length-Dependent Electron Transmission of Fullerene-Capped Chiral Nanotubes Sandwiched in Gold Electrodes”, Phys. Chem. Chem. Phys. 2024, 26(4), 3474-3481. 

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42. Sudip Sarkar, Ameet Kumar, Daeheum Cho+, "Spin-polarized Electrical Transport Properties of Organic Radicals in Presence of Zigzag-Graphene Nanoribbon Leads", J. Chem. Phys. 2024, 160(4). 

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41. Muhammad Salman, Ji Won Lee, Sang Hyuk Lee, Min Ho Lee, Van Duc Pham, Min-Sik Kim, Daeheum Cho+, Hye Jin Lee, “A comparative study of ammonia solubility in imidazolium-based ionic liquids with different structural compositions”, Heliyon. 2024, 10(2), 24305.

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40. Bhargavi Rani Anne, Joyjit Kundu, Mrinal Kanti Kabiraz, Jeonghyeon Kim, Daeheum Cho, Sang-Il Choi, “A Review on MXene as Promising Support Materials for Oxygen Evolution Reaction Catalysts”, Adv. Funct. Mater. 2023, 33(51), 2306100.

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39. Soyoung Jeon, Yuri Jeong, Le Ngoc Tram Anh, Jeyun Ju, Daeheum Cho, Yoon Jung Jang, Ryuya Tokunaga, Shinya Hayami, Kil Sik Min, “Synthesis, crystal structure, luminescent properties, and magnetic properties of lanthanide(III) complexes containing the chiral (S,S/R,R)-N,N'-bis(3,5-dinitrosalicylidene)-1,2-cyclohexanediamine ligand”, J. Ind. Eng. Chem. 2023, 128, 275-285.

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38. Daeheum Cho+, “Carbon-based organic radical spin filters”, Bull. Korean Chem. Soc. 2023, 44(8), 700-704.​

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37. Won Hui Doh, Hiroshi Kondoh, Eonhyoung Ahn, Dohyun Park, Daeheum Cho+ and Chang Min Kim, “Direct chlorination of ethene by hot chlorine atoms on a ZnO (0001 ̅) surface”, J. Phys. Chem. C. 2023, 127(18), 8523-8528. 

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36. Daeheum Cho+ and Jin Yong Lee, "Organic Stable Radical Oligomers As Spin Filters", J. Phys. Chem. C. 2023, 127(17), 8256-8262.

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35. Yeonsig Nam, Daeheum Cho+, Bing Gu, Jérémy R. Rouxel, Daniel Keefer, Niranjan Govind, and Shaul Mukamel*, "Time-Evolving Chirality Loss in Molecular Photodissociation Monitored by X-ray Circular Dichroism Spectroscopy" J. Am. Chem. Soc. 2022, 144(44), 20400-20410.

 

34. Woojin Park, Marc Alías-Rodríguez, Daeheum Cho, Seunghoon Lee, Miquel Huix-Rotllant, and Cheol Ho Choi, "Mixed-Reference Spin-Flip Time-Dependent Density Functional Theory for Accurate X-ray Absorption Spectroscopy" J. Chem. Theory Comput. 2022, 18, 10, 6240–6250.

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33. Daeheum Cho+, Bing Gu, and Shaul Mukamel, "Optical Cavity Manipulation and Nonlinear UV Molecular Spectroscopy of Conical Intersections in Pyrazine" J. Am. Chem. Soc. 2022, 144(17), 17, 7758–7767.

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32. Fatemeh Khalili, Mohsen Vafaee, Daeheum Cho, Babak Shokri, "Charge Migration Analysis in Caffeine Molecule: A Real-Time Time-Dependent Density Functional Theory" Int. J. Quant. Chem. 2021, 121(19), 26754.

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31. Daeheum Cho+, Jérémy R. Rouxel, and Shaul Mukamel, "Stimulated X-ray Resonant Raman Spectroscopy of Conical Intersections in Thiophenol" J. Phys. Chem. Lett. 2020, 11, 4292-4297.

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30. Daeheum Cho+ and Shaul Mukamel, "Stimulated X‑ray Raman Imaging of Conical Intersections" J. Phys. Chem. Lett. 2020, 11(1), 33−39.

 

29. Abbas Salimi, Daeheum Cho+, Jin Yong Lee, Sunwoo Kang, and Shaul Mukamel, "Signatures of Through-Space Charge Transfer in Two-Photon Absorption of Paracyclophane Derivatives" Bull. Korean Chem. Soc. 2019, 40(11), 1076-1086.

 

28. Daeheum Cho+, Jeremy R. Rouxel, Shaul Mukamel, Garnet Kin-Lic Chan, and Zhendong Li, "Stimulated X-ray Raman and Absorption Spectroscopy of Iron-Sulfur Dimers" J. Phys. Chem. Lett. 2019, 10(21), 6664-6671.

 

27. Shahaf Asban, Daeheum Cho+, Shaul Mukamel, "Frequency-, Time-, and Wavevector-Resolved Ultrafast Incoherent Diffraction of Noisy X-ray Pulses", J. Phys. Chem. Lett. 2019, 10(19), 5805-5814.

 

26. Daeheum Cho+, Jérémy R. Rouxel, Markus Kowalewski, Jin Yong Lee, and Shaul Mukamel, "Imaging of transition charge densities involving carbon core excitations by all X-ray sum-frequency generation", Phil. Trans. R. Soc. A. 2019, 377(2145), 20170470.

 

25. Konstantin E. Dorfman, Shahaf Asban, Lyuzhou Ye, Jérémy R. Rouxel, Daeheum Cho, and Shaul Mukamel, "Monitoring Spontaneous Charge-Density Fluctuations by Single-Molecule Diffraction of Quantum Light", J. Phys. Chem. Lett. 2019, 10(4), 768-773.

 

24. Si Wu, Yuan Yuan, Daeheum Cho+, Jin Yong Lee, and Baotao Kang, "Chiral γ-Graphyne Nanotubes with Almost Equivalent Band Gaps", J. Chem. Phys., 2019, 150(5), 054706.

 

23. Lyuzhou Ye, Jérémy R. Rouxel, Daeheum Cho, and Shaul Mukamel, "Imaging electron-density fluctuations by multidimensional X-ray photon-coincidence diffraction", Proc. Natl. Acad. Sci. U.S.A., 2019, 116(2), 395-400.

 

22. Jong Hyeon Lim, Daeheum Cho, Heon Kang, and Jin Yong Lee, "Electronic and Nuclear Contributions to Vibrational Stark Shifts of Hydroxyl Stretching Frequencies of Water Clusters", J. Phys. Chem. C, 2018, 122(24), 12970-12974.

 

21. Daeheum Cho+, Jérémy Rouxel, Markus Kowalewski, Prasoon Saurabh, Jin Yong Lee, and Shaul Mukamel, "Phase Cycling RT-TDDFT Simulation Protocol for Nonlinear XUV and X-ray Molecular Spectroscopy", J. Phys. Chem. Lett. 2018, 9(5), 1072-1078.

 

20. Daeheum Cho+, Jérémy Rouxel, Markus Kowalewski, Jin Yong Lee, and Shaul Mukamel, "Attosecond X-ray diffraction triggered by core or valence ionization of a dipeptide", J. Chem. Theory Comput. 2018, 14(1), 329-338.

 

19. Minhe Lee, Daeheum Cho, Inwon Kim, Juhyen Lee, Jin Yong Lee, Chinnadurai Satheeshkumar, Changsik Song, "Cooperative Binding of Metal Cations to a Spiropyran-Conjugated Calix[4]arene", ChemistrySelect 2017, 2(12), 3527-3533.

 

18. Yeonsig Nam, Daeheum Cho, and Jin Yong Lee, "Electric Field Effect on the Magnetic Properties of Zigzag MoS2 Nanoribbons with Different Edge Passivation", Phys. Chem. Chem. Phys. 2017, 19(45), 30814-30821.

 

17. Baotao Kang, Daeheum Cho+, and Jin Yong Lee, "Periodicity of Band Gaps of Chiral a-Graphyne Nanotubes", Phys. Chem. Chem. Phys. 2017, 19(11), 7919-7922.

 

16. Daeheum Cho, Kyoung Chul Ko, Oriol Lamiel-García, Stefan T. Bromley, Jin Yong Lee, and Francesc Illas, "Effect of Size and Structure on the Ground and Excited State Electronic Structure of TiO2 Nanoparticles", J. Chem. Theory Comput. 2016, 12(8), 3751-3763.

 

15. Won Young Kim, Hu Shi, Hyo Sung Jung, Daeheum Cho, Jin Yong Lee, and Jong Seung Kim, "Coumarin-decorated Schiff base hydrolysis as an efficient driving force for the fluorescent detection of water in organic solvents", Chem. Commun. 2016, 52, 8675-8678.

 

14. Yeonsig Nam, Daeheum Cho, and Jin Yong Lee, "Doping Effect on Edge Terminated Ferromagnetic Graphene Nanoribbons", J. Phys. Chem. C 2016, 120(20), 11237-11244.

 

13. Daeheum Cho, Kyoung Chul Ko, and Jin Yong Lee, "Quantum Chemical Approaches for Controlling and Evaluating Intramolecular Magnetic Interaction in Organic Diradicals", Int. J. Quant. Chem. 2016, 116(8), 578-597.

 

12. Daeheum Cho, Yasuhiro Ikabata, Takeshi Yoshikawa, Jin Yong Lee, and Nakai Hiromi, "Theoretical Study of Extremely Long yet Stable Carbon-Carbon Bonds: Effect of Attractive C-H Interactions and Small Radical Stabilization of Diamondoids", Bull. Chem. Soc. Jpn. 2015, 88(12) 1636-1641.

 

11. Kyung-su Kim, Inhwan Cha, Daeheum Cho, Jongho Ahn, Chinnadurai Satheeshkumar, Ki Seok Yang, Jin Yong Lee, Yunmi Lee, and Changsik Song, "Torsionally Responsive Tropone-Fused Conjugated Polymers", Macromolecules 2015, 48(19), 7015-7023.

 

10. Sunghwan Shin, Han-I Kang, Daeheum Cho, and Jin Yong Lee, and Heon Kang, "Effect of Electric Field on Condensed-Phase Molecular Systems. II. Stark Effect on the Hydroxyl Stretch Vibration of Ice", J. Phys. Chem. C 2015, 119(27), 15596-15603.

 

9. Daeheum Cho, Kyoung Chul Ko, Heesoo Park, and Jin Yong Lee, "Ferromagnetic Graphene Nanoribbons: Edge Termination with Organic Radicals", J. Phys. Chem. C 2015, 119(18), 10109-10115.

 

8. Daeheum Cho, Kyoung Chul Ko, Yasuhiro Ikabata, Kazufumi Wakayama, Takeshi Yoshikawa, Hiromi Nakai, and Jin Yong Lee, "Effect of Hartree-Fock Exact Exchange on Intramolecular Magnetic Coupling Constants of Organic Diradicals", J. Chem. Phys. 2015, 142(2), 024318.

 

7. Kyoung Chul Ko, Young Geun Park, Daeheum Cho, and Jin Yong Lee, "Simple but Useful Scheme toward Understanding of Intramolecular Magnetic Interactions: Benzene-Bridged Oxoverdazyl Diradicals", J. Phys. Chem. A 2014, 118(40), 9596-9606.

 

6. Daeheum Cho, Kyoung Chul Ko, and Jin Yong Lee, "Organic Magnetic Diradicals (Radical-Coupler-Radical): Standardization of Couplers for Strong Ferromagnetism", J. Phys. Chem. A 2014, 118(27), 5112-5121.

 

5. Yang-Rae Kim, R. Soyoung Kim, Sun Kil Kang, Myung Gil Choi, Jung Ok Moon, Daeheum Cho, Jin Yong Lee, Suk-Kyu Chang, and Taek Dong Chung, "Modulation of quinone PCET reaction by Ca2+ ion captured by calix[4]quinone in water", J. Am. Chem. Soc. 2013, 135(50), 18957-18967.

 

4. Daeheum Cho, Kyoung Chul Ko, and Jin Yong Lee, "Catalytic Mechanism for the Ru-Complex Catalyzed Synthesis of Amides from Alcohols and Amines: A DFT Study", Organometallics 2013, 32(16), 4571-4576.

 

3. Kyoung Chul Ko, Daeheum Cho, and Jin Yong Lee, "Scaling Approach for Intramolecular Magnetic Coupling Constants of Organic Diradicals", J. Phys. Chem. A 2013, 117(16), 3561-3568.

 

2. Min Soo Kang, Sung ho Kang, Sang Gyun kim, In Taek Choi, Jung Ho Ryu, Daeheum Cho, Jin Yong Lee, and Hwan Kyu Kim, "Novel D–π–A structured Zn(II)-porphyrin dyes containing a bis(3,3-dimethylfluorenyl)amine moiety for dye-sensitised solar cells", Chem. Comm. 2012, 48, 9349-9351.

 

1. Kyoung Chul Ko, Daeheum Cho, and Jin Yong Lee, "Systematic Approach to Design Organic Magnetic Molecuels: Strongly Coupled Diradicals with Ethylene Coupler", J. Phys. Chem. A 2012, 116(25), 6837-6844.

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(+ Correspondence to Daeheum Cho)