| Year |
Citation |
Score |
| 2020 |
Kang S, Woo J, Kim J, Kim H, Kim Y, Lim J, Choi S, Kim WY. ACE-Molecule: An open-source real-space quantum chemistry package. The Journal of Chemical Physics. 152: 124110. PMID 32241122 DOI: 10.1063/5.0002959 |
0.314 |
|
| 2019 |
Lee J, Yoo C, Lee YA, Park SH, Cho Y, Jun JH, Kim WY, Kim B, Yoon H. Single-crystalline Co2Si nanowires directly synthesized on silicon substrate for high-performance micro-supercapacitor Chemical Engineering Journal. 370: 973-979. DOI: 10.1016/J.Cej.2019.03.269 |
0.301 |
|
| 2018 |
Kim J, Kang S, Lim J, Kim WY. Study of Li Adsorption on Graphdiyne Using Hybrid DFT Calculations. Acs Applied Materials & Interfaces. PMID 29745641 DOI: 10.1021/Acsami.8B03482 |
0.328 |
|
| 2018 |
Hwang SY, Kim J, Kim WY. Fragment-orbital tunneling currents and electronic couplings for analysis of molecular charge-transfer systems. Physical Chemistry Chemical Physics : Pccp. PMID 29560997 DOI: 10.1039/C8Cp00266E |
0.336 |
|
| 2018 |
Choi S, Kim WY, Yeom MS, Ryu H. On the achievement of high fidelity and scalability for large-scale diagonalizations in grid-based DFT simulations International Journal of Quantum Chemistry. 118: e25622. DOI: 10.1002/Qua.25622 |
0.301 |
|
| 2017 |
Kim J, Hong K, Hwang SY, Ryu S, Choi S, Kim WY. Effects of the locality of a potential derived from hybrid density functionals on Kohn-Sham orbitals and excited states. Physical Chemistry Chemical Physics : Pccp. PMID 28374031 DOI: 10.1039/C7Cp00704C |
0.341 |
|
| 2016 |
Lim J, Choi S, Kim J, Kim WY. Outstanding performance of configuration interaction singles and doubles using exact exchange Kohn-Sham orbitals in real-space numerical grid method. The Journal of Chemical Physics. 145: 224309. PMID 27984905 DOI: 10.1063/1.4971786 |
0.337 |
|
| 2016 |
Lim J, Choi S, Kang S, Kim J, Hong K, Kim WY. Improvement of initial guess via grid-cutting for efficient grid-based density functional calculations International Journal of Quantum Chemistry. 116: 1397-1403. DOI: 10.1002/Qua.25193 |
0.328 |
|
| 2016 |
Kang S, Ryu S, Choi S, Kim J, Hong K, Kim WY. Update to ACE-molecule: Projector augmented wave method on lagrange-sinc basis set International Journal of Quantum Chemistry. 116: 644-650. DOI: 10.1002/Qua.25106 |
0.308 |
|
| 2015 |
Choi S, Hong K, Kim J, Kim WY. Accuracy of Lagrange-sinc functions as a basis set for electronic structure calculations of atoms and molecules. The Journal of Chemical Physics. 142: 094116. PMID 25747070 DOI: 10.1063/1.4913569 |
0.328 |
|
| 2015 |
Kim Y, Kim WY. Universal structure conversion method for organic molecules: From atomic connectivity to three-dimensional geometry Bulletin of the Korean Chemical Society. 36: 1769-1777. DOI: 10.1002/Bkcs.10334 |
0.313 |
|
| 2015 |
Kim J, Hong K, Choi S, Kim WY. Feature of Exact Exchange Kohn–Sham Orbitals with Krieger–Li–Iafrate Approximation# Bulletin of the Korean Chemical Society. 36: 998-1007. DOI: 10.1002/Bkcs.10189 |
0.326 |
|
| 2013 |
Cho Y, Min SK, Yun J, Kim WY, Tkatchenko A, Kim KS. Noncovalent Interactions of DNA Bases with Naphthalene and Graphene. Journal of Chemical Theory and Computation. 9: 2090-6. PMID 26583555 DOI: 10.1021/Ct301097U |
0.426 |
|
| 2011 |
Cho Y, Min SK, Kim WY, Kim KS. The origin of dips for the graphene-based DNA sequencing device. Physical Chemistry Chemical Physics : Pccp. 13: 14293-6. PMID 21617796 DOI: 10.1039/C1Cp20760A |
0.41 |
|
| 2011 |
Cho WJ, Cho Y, Min SK, Kim WY, Kim KS. Chromium porphyrin arrays as spintronic devices. Journal of the American Chemical Society. 133: 9364-9. PMID 21612202 DOI: 10.1021/Ja111565W |
0.437 |
|
| 2011 |
Min SK, Kim WY, Cho Y, Kim KS. Fast DNA sequencing with a graphene-based nanochannel device. Nature Nanotechnology. 6: 162-5. PMID 21297626 DOI: 10.1038/Nnano.2010.283 |
0.404 |
|
| 2010 |
Lee EC, Choi YC, Kim WY, Singh NJ, Lee S, Shim JH, Kim KS. A radical polymer as a two-dimensional organic half metal. Chemistry (Weinheim An Der Bergstrasse, Germany). 16: 12141-6. PMID 20839182 DOI: 10.1002/Chem.201000858 |
0.418 |
|
| 2010 |
Kim WY, Kim KS. Tuning molecular orbitals in molecular electronics and spintronics. Accounts of Chemical Research. 43: 111-20. PMID 19769353 DOI: 10.1021/Ar900156U |
0.48 |
|
| 2009 |
Choi YC, Kim WY, Lee HM, Kim KS. Neutral and Anionic Gold Decamers: Planar Structure with Unusual Spatial Charge-Spin Separation. Journal of Chemical Theory and Computation. 5: 1216-23. PMID 26609712 DOI: 10.1021/Ct8003113 |
0.436 |
|
| 2009 |
Kim WY, Choi YC, Min SK, Cho Y, Kim KS. Application of quantum chemistry to nanotechnology: electron and spin transport in molecular devices. Chemical Society Reviews. 38: 2319-33. PMID 19623353 DOI: 10.1039/B820003C |
0.455 |
|
| 2009 |
Cho Y, Kim WY, Kim KS. Effect of electrodes on electronic transport of molecular electronic devices. The Journal of Physical Chemistry. A. 113: 4100-4. PMID 19284720 DOI: 10.1021/Jp810467Q |
0.44 |
|
| 2009 |
Lee JY, Hong BH, Kim WY, Min SK, Kim Y, Jouravlev MV, Bose R, Kim KS, Hwang IC, Kaufman LJ, Wong CW, Kim P. Near-field focusing and magnification through self-assembled nanoscale spherical lenses Nature. 460: 498-501. DOI: 10.1038/Nature08173 |
0.385 |
|
| 2008 |
Kim WY, Kim KS. Prediction of very large values of magnetoresistance in a graphene nanoribbon device Nature Nanotechnology. 3: 408-412. PMID 18654564 DOI: 10.1038/Nnano.2008.163 |
0.426 |
|
| 2008 |
Kim WY, Kim KS. Carbon nanotube, graphene, nanowire, and molecule-based electron and spin transport phenomena using the nonequilibrium Green's function method at the level of first principles theory Journal of Computational Chemistry. 29: 1073-1083. PMID 18072178 DOI: 10.1002/Jcc.20865 |
0.481 |
|
| 2008 |
Kim WY, Choi YC, Kim KS. Understanding structures and electronic/spintronic properties of single molecules, nanowires, nanotubes, and nanoribbons towards the design of nanodevices Journal of Materials Chemistry. 18: 4510-4521. DOI: 10.1039/B804359K |
0.469 |
|
| 2007 |
Choi YC, Lee HM, Kim WY, Kwon SK, Nautiyal T, Cheng DY, Vishwanathan K, Kim KS. How can we make stable linear monoatomic chains? Gold-cesium binary subnanowires as an example of a charge-transfer-driven approach to alloying. Physical Review Letters. 98: 076101. PMID 17359037 DOI: 10.1103/Physrevlett.98.076101 |
0.39 |
|
| 2007 |
Kim WY, Kwon SK, Kim KS. Negative differential resistance of carbon nanotube electrodes with asymmetric coupling phenomena Physical Review B. 76. DOI: 10.1103/Physrevb.76.033415 |
0.355 |
|
| 2006 |
Cheng D, Kim WY, Min SK, Nautiyal T, Kim KS. Magic structures and quantum conductance of silver nanowires. Physical Review Letters. 96: 096104. PMID 16606283 DOI: 10.1103/Physrevlett.96.096104 |
0.393 |
|
| 2005 |
Choi YC, Kim WY, Park KS, Tarakeshwar P, Kim KS, Kim TS, Lee JY. Role of molecular orbitals of the benzene in electronic nanodevices. The Journal of Chemical Physics. 122: 094706. PMID 15836161 DOI: 10.1063/1.1858851 |
0.527 |
|
| 2005 |
Kim WY, Nautiyal T, Youn SJ, Kim KS. Anomalous behavior of mercury in one dimension: Density-functional calculations Physical Review B. 71. DOI: 10.1103/Physrevb.71.113104 |
0.409 |
|
| 2004 |
Lee H, Tarakeshwar P, Park J, Kolaski, Yoon Y, Yi H, Kim WY, Kim K. Insights into the Structures, Energetics, and Vibrations of Monovalent Cation-(Water)1-6 Clusters † Journal of Physical Chemistry A. 108: 2949-2958. DOI: 10.1021/Jp0369241 |
0.406 |
|
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