| Year |
Citation |
Score |
| 2020 |
Weck PF, Jové-Colón CF, Kim E. Thermodynamic Properties of Metaschoepite Predicted from Density Functional Perturbation Theory Chemical Physics Letters. 757: 137878. DOI: 10.1016/J.Cplett.2020.137878 |
0.384 |
|
| 2020 |
Kim E, Weck PF, Greathouse JA, Gordon ME, Bryan CR. Radionuclide incorporation in negative thermal expansion α-Zr(WO4)2: A density functional theory study Chemical Physics Letters. 744: 137172. DOI: 10.1016/J.Cplett.2020.137172 |
0.318 |
|
| 2019 |
Greathouse JA, Weck PF, Gordon ME, Kim E, Bryan CR. Molecular dynamics simulation of zirconium tungstate amorphization and the amorphous-crystalline interface. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 32: 085401. PMID 31741462 DOI: 10.1088/1361-648X/Ab5377 |
0.335 |
|
| 2019 |
Weck PF, Jové-Colón CF, Kim E. Structure-thermodynamics relationship of schoepite from first-principles. Physical Chemistry Chemical Physics : Pccp. PMID 31576855 DOI: 10.1039/C9Cp04117F |
0.369 |
|
| 2019 |
Morrison TD, Wood ES, Weck PF, Kim E, Woo SO, Nelson AT, Naugle DG. A comprehensive assessment of the low-temperature thermal properties and thermodynamic functions of CeO. The Journal of Chemical Physics. 151: 044202. PMID 31370517 DOI: 10.1063/1.5110178 |
0.301 |
|
| 2019 |
Kim E, Lee YH. Structural, electronic, and vibrational properties of liquid and amorphous silicon: Tight-binding molecular-dynamics approach. Physical Review. B, Condensed Matter. 49: 1743-1749. PMID 10010967 DOI: 10.1103/Physrevb.49.1743 |
0.45 |
|
| 2019 |
Kim E, Lee YH, Lee JY. Fragmentation of C60 and C70 clusters. Physical Review. B, Condensed Matter. 48: 18230-18234. PMID 10008463 DOI: 10.1103/Physrevb.48.18230 |
0.392 |
|
| 2019 |
Woo SJ, Kim E, Lee YH. Geometric, electronic, and vibrational structures of C50, C60, C70, and C80. Physical Review. B, Condensed Matter. 47: 6721-6727. PMID 10004644 DOI: 10.1103/Physrevb.47.6721 |
0.406 |
|
| 2019 |
Kim E, Lee YH. Electronic structure of vacancies in amorphous silicon. Physical Review. B, Condensed Matter. 51: 5429-5432. PMID 9979424 DOI: 10.1103/Physrevb.51.5429 |
0.431 |
|
| 2019 |
Weck PF, Kim E, Gordon ME, Greathouse JA, Meserole SP, Bryan CR. Elucidating Structure–Spectral Property Relationships of NegativeThermal Expansion Zr 2 (WO 4 )(PO 4 ) 2 : A First-Principles Study with Experimental Validation Journal of Physical Chemistry C. 123: 21607-21616. DOI: 10.1021/Acs.Jpcc.9B06069 |
0.349 |
|
| 2019 |
Schyck S, Evlyukhin E, Kim E, Pravica M. High Pressure Behavior of Mercury Difluoride (HgF2) Chemical Physics Letters. 724: 35-41. DOI: 10.1016/J.Cplett.2019.03.045 |
0.342 |
|
| 2018 |
Kearney J, Grauzinyte M, Smith D, Gulans A, Sneed D, Childs C, Hinton J, Park C, Smith J, Kim E, Fitch SDS, Hector AL, Pickard CJ, Flores-Livas JA, Salamat A. Pressure tuneable visible-range band gap in the ionic spinel tin nitride. Angewandte Chemie (International Ed. in English). PMID 30022577 DOI: 10.1002/Anie.201805038 |
0.325 |
|
| 2018 |
Evlyukhin E, Kim E, Goldberger D, Cifligu P, Schyck S, Weck PF, Pravica M. High-pressure-assisted X-ray-induced damage as a new route for chemical and structural synthesis. Physical Chemistry Chemical Physics : Pccp. PMID 29868652 DOI: 10.1039/C8Cp02119H |
0.312 |
|
| 2018 |
Lavina B, Kim E, Cynn H, Weck PF, Seaborg K, Siska E, Meng Y, Evans W. Phosphorus Dimerization in Gallium Phosphide at High Pressure. Inorganic Chemistry. PMID 29424535 DOI: 10.1021/Acs.Inorgchem.7B02478 |
0.367 |
|
| 2018 |
Kim E, Weck PF, Mattsson TR. Reverse-martensitic hcp-to-fcc transformation in technetium under shock compression Journal of Applied Physics. 124: 35903. DOI: 10.1063/1.5040148 |
0.33 |
|
| 2018 |
Jooya H, McKay K, Kim E, Weck P, Pappas D, Hite D, Sadeghpour H. Mechanisms for carbon adsorption on Au(110)-(2 × 1): A work function analysis Surface Science. 677: 232-238. DOI: 10.1016/J.Susc.2018.07.008 |
0.306 |
|
| 2018 |
Weck PF, Kim E, Greathouse JA, Gordon ME, Bryan CR. Assessing exchange-correlation functionals for elasticity and thermodynamics of α-ZrW2O8: A density functional perturbation theory study Chemical Physics Letters. 698: 195-199. DOI: 10.1016/J.Cplett.2018.03.025 |
0.354 |
|
| 2018 |
Kim E, Weck PF, Borjas R, Poineau F. Lattice dynamics and thermomechanical properties of zirconium(IV) chloride: Evidence for low-temperature negative thermal expansion Chemical Physics Letters. 691: 98-102. DOI: 10.1016/J.Cplett.2017.10.065 |
0.337 |
|
| 2018 |
Weck PF, Gordon ME, Greathouse JA, Bryan CR, Meserole SP, Rodriguez MA, Payne C, Kim E. Infrared and Raman spectroscopy of α‐ZrW2O8: A comprehensive density functional perturbation theory and experimental study Journal of Raman Spectroscopy. 49: 1373-1384. DOI: 10.1002/Jrs.5396 |
0.328 |
|
| 2017 |
Weck PF, Kim E, Wang Y, Kruichak JN, Mills MM, Matteo EN, Pellenq RJ. Model representations of kerogen structures: An insight from density functional theory calculations and spectroscopic measurements. Scientific Reports. 7: 7068. PMID 28765559 DOI: 10.1038/S41598-017-07310-9 |
0.338 |
|
| 2017 |
Weck PF, Juan P, Dingreville R, Kim E. Density Functional Analysis of Fluorite-Structured (Ce, Zr)O2/CeO2 Interfaces Journal of Physical Chemistry C. 121: 14678-14687. DOI: 10.1021/Acs.Jpcc.7B03902 |
0.365 |
|
| 2016 |
Ackerman M, Kim E, Weck PF, Chernesky W, Czerwinski KR. Technetium incorporation in scheelite: insights from first-principles. Dalton Transactions (Cambridge, England : 2003). PMID 27792232 DOI: 10.1039/C6Dt03626K |
0.372 |
|
| 2016 |
Weck PF, Kim E. Uncloaking the Thermodynamics of the Studtite to Metastudtite Shear-Induced Transformation Journal of Physical Chemistry C. 120: 16553-16560. DOI: 10.1021/Acs.Jpcc.6B05967 |
0.304 |
|
| 2016 |
Mast DS, Kim E, Siska EM, Poineau F, Czerwinski KR, Lavina B, Forster PM. Equation of state for technetium from X-ray diffraction and first-principle calculations Journal of Physics and Chemistry of Solids. 95: 6-11. DOI: 10.1016/J.Jpcs.2016.03.007 |
0.323 |
|
| 2016 |
Riddle C, Czerwinski K, Kim E, Paviet P, Weck P, Poineau F, Conradson S. Characterization of pentavalent and hexavalent americium complexes in nitric acid using X-ray absorption fine structure spectroscopy and first-principles modeling Journal of Radioanalytical and Nuclear Chemistry. 1-9. DOI: 10.1007/S10967-016-4704-X |
0.347 |
|
| 2015 |
Weck PF, Kim E, Tikare V, Mitchell JA. Mechanical properties of zirconium alloys and zirconium hydrides predicted from density functional perturbation theory. Dalton Transactions (Cambridge, England : 2003). 44: 18769-79. PMID 26478228 DOI: 10.1039/C5Dt03403E |
0.314 |
|
| 2015 |
Weck PF, Kim E. Thermodynamics of technetium: reconciling theory and experiment using density functional perturbation analysis. Dalton Transactions (Cambridge, England : 2003). PMID 26087249 DOI: 10.1039/C5Dt01639H |
0.362 |
|
| 2015 |
Weck PF, Kim E, Jové-Colón CF. Relationship between crystal structure and thermo-mechanical properties of kaolinite clay: beyond standard density functional theory. Dalton Transactions (Cambridge, England : 2003). 44: 12550-60. PMID 25761796 DOI: 10.1039/C5Dt00590F |
0.378 |
|
| 2015 |
Johnson TJ, Sweet LE, Meier DE, Mausolf EJ, Kim E, Weck PF, Buck EC, McNamara BK. Dehydration of uranyl nitrate hexahydrate to the trihydrate under ambient conditions as observed via dynamic infrared reflectance spectroscopy Proceedings of Spie - the International Society For Optical Engineering. 9455. DOI: 10.1117/12.2179704 |
0.337 |
|
| 2014 |
Weck PF, Kim E. Layered uranium(VI) hydroxides: structural and thermodynamic properties of dehydrated schoepite α-UO₂(OH)₂. Dalton Transactions (Cambridge, England : 2003). 43: 17191-9. PMID 25318965 DOI: 10.1039/C4Dt02455A |
0.352 |
|
| 2014 |
Kim E, Weck PF, Taylor CD, Olatunji-Ojo O, Liu XY, Mausol E, Jarvinen GD, Czerwinski KR. First-principles and kinetic monte carlo simulation studies of the reactivity of Tc(0001), MoTc(111) and MoTc(110) surfaces Journal of the Electrochemical Society. 161. DOI: 10.1149/2.097401Jes |
0.311 |
|
| 2014 |
Weck PF, Kim E. Solar Energy Storage in Phase Change Materials: First-Principles Thermodynamic Modeling of Magnesium Chloride Hydrates. Journal of Physical Chemistry C. 118: 4618-4625. DOI: 10.1021/Jp411461M |
0.346 |
|
| 2014 |
Weck PF, Kim E, Jové-Colón CF, Sassani DC. First-principles study of anhydrite, polyhalite and carnallite Chemical Physics Letters. 594: 1-5. DOI: 10.1016/J.Cplett.2014.01.015 |
0.378 |
|
| 2013 |
Malliakas CD, Poineau F, Johnstone EV, Weck PF, Kim E, Scott BL, Forster PM, Kanatzidis MG, Czerwinski KR, Sattelberger AP. β-Technetium dichloride: solid-state modulated structure, electronic structure, and physical properties. Journal of the American Chemical Society. 135: 15955-62. PMID 24053573 DOI: 10.1021/Ja408459K |
0.35 |
|
| 2013 |
Weck PF, Kim E, Czerwinski KR. Semiconducting layered technetium dichalcogenides: insights from first-principles. Dalton Transactions (Cambridge, England : 2003). 42: 15288-95. PMID 24030159 DOI: 10.1039/C3Dt51903A |
0.399 |
|
| 2013 |
Poineau F, Weck PF, Burton-Pye BP, Denden I, Kim E, Kerlin W, German KE, Fattahi M, Francesconi LC, Sattelberger AP, Czerwinski KR. Reactivity of HTcO4 with methanol in sulfuric acid: Tc-sulfate complexes revealed by XAFS spectroscopy and first principles calculations Dalton Transactions. 42: 4348-4352. PMID 23403900 DOI: 10.1039/C3Dt32951H |
0.326 |
|
| 2013 |
Weck PF, Kim E, Jové-Colón CF, Sassani DC. On the role of strong electron correlations in the surface properties and chemistry of uranium dioxide. Dalton Transactions (Cambridge, England : 2003). 42: 4570-8. PMID 23354003 DOI: 10.1039/C3Dt32536A |
0.338 |
|
| 2013 |
Johnstone EV, Weck PF, Poineau F, Kim E, Forster PM, Sattelberger AP, Czerwinski KR. X-ray crystallographic and first-principles theoretical studies of K 2[TcOCl5] and UV/Vis investigation of the [TcOCl 5]2- and [TcOCl4]- ions European Journal of Inorganic Chemistry. 1097-1104. DOI: 10.1002/Ejic.201201346 |
0.374 |
|
| 2012 |
Weck PF, Kim E, Jové-Colón CF, Sassani DC. Structures of uranyl peroxide hydrates: a first-principles study of studtite and metastudtite. Dalton Transactions (Cambridge, England : 2003). 41: 9748-52. PMID 22763414 DOI: 10.1039/C2Dt31242E |
0.331 |
|
| 2012 |
Poineau F, Johnstone EV, Weck PF, Kim E, Conradson SD, Sattelberger AP, Czerwinski KR. On the structure of β-molybdenum dichloride. Inorganic Chemistry. 51: 4965-71. PMID 22497564 DOI: 10.1021/Ic202680J |
0.304 |
|
| 2012 |
Ferrier M, Weck PF, Poineau F, Kim E, Stebbins A, Ma L, Sattelberger AP, Czerwinski KR. First evidence for the formation of technetium oxosulfide complexes: Synthesis, structure and characterization Dalton Transactions. 41: 6291-6298. PMID 22495730 DOI: 10.1039/C2Dt30063J |
0.322 |
|
| 2012 |
Silva GW, Weck PF, Kim E, Yeamans CB, Cerefice GS, Sattelberger AP, Czerwinski KR. Crystal and electronic structures of neptunium nitrides synthesized using a fluoride route. Journal of the American Chemical Society. 134: 3111-9. PMID 22280303 DOI: 10.1021/Ja209503N |
0.344 |
|
| 2011 |
Lavina B, Dera P, Kim E, Meng Y, Downs RT, Weck PF, Sutton SR, Zhao Y. Discovery of the recoverable high-pressure iron oxide Fe4O5. Proceedings of the National Academy of Sciences of the United States of America. 108: 17281-5. PMID 21969537 DOI: 10.1073/Pnas.1107573108 |
0.315 |
|
| 2011 |
Chang K, Kim E, Weck PF, Tománek D. Nanoconfinement effects on the reversibility of hydrogen storage in ammonia borane: a first-principles study. The Journal of Chemical Physics. 134: 214501. PMID 21663361 DOI: 10.1063/1.3594115 |
0.358 |
|
| 2011 |
Weck PF, Kim E, Czerwinski KR. Interplay between structure, stoichiometry and properties of technetium nitrides. Dalton Transactions (Cambridge, England : 2003). 40: 6738-44. PMID 21611660 DOI: 10.1039/C1Dt10334B |
0.349 |
|
| 2011 |
Poineau F, Malliakas CD, Weck PF, Scott BL, Johnstone EV, Forster PM, Kim E, Kanatzidis MG, Czerwinski KR, Sattelberger AP. Technetium dichloride: a new binary halide containing metal-metal multiple bonds. Journal of the American Chemical Society. 133: 8814-7. PMID 21574580 DOI: 10.1021/Ja201788M |
0.315 |
|
| 2011 |
Weck PF, Gong CM, Kim E, Thuéry P, Czerwinski KR. One-dimensional uranium-organic coordination polymers: crystal and electronic structures of uranyl-diacetohydroxamate. Dalton Transactions (Cambridge, England : 2003). 40: 6007-11. PMID 21552577 DOI: 10.1039/C1Dt10267B |
0.332 |
|
| 2011 |
Weck PF, Sergeeva AP, Kim E, Boldyrev AI, Czerwinski KR. Chemical bonding and aromaticity in trinuclear transition-metal halide clusters. Inorganic Chemistry. 50: 1039-46. PMID 21190332 DOI: 10.1021/Ic101779W |
0.319 |
|
| 2010 |
Weck PF, Kim E, Poineau F, Rodriguez EE, Sattelberger AP, Czerwinski KR. Structural and electronic trends in rare-earth technetate pyrochlores. Dalton Transactions (Cambridge, England : 2003). 39: 7207-10. PMID 20571708 DOI: 10.1039/C0Dt00212G |
0.321 |
|
| 2010 |
Poineau F, Hartmann T, Weck PF, Kim E, Silva GW, Jarvinen GD, Czerwinski KR. Structural studies of technetium-zirconium alloys by X-ray diffraction, high-resolution electron microscopy, and first-principles calculations. Inorganic Chemistry. 49: 1433-8. PMID 20085255 DOI: 10.1021/Ic9016257 |
0.39 |
|
| 2010 |
Weck PF, Kim E, Masci B, Thuéry P, Czerwinski KR. Density functional analysis of the trigonal uranyl equatorial coordination in hexahomotrioxacalix[3]arene-based macrocyclic complexes. Inorganic Chemistry. 49: 1465-70. PMID 20055471 DOI: 10.1021/Ic901694G |
0.352 |
|
| 2010 |
Weck PF, Kim E, Czerwinski KR, Tománek D. Structural and magnetic properties of Tcn @ C60 endohedral metalofullerenes: First-principles predictions Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.125448 |
0.311 |
|
| 2010 |
Pravica M, Kim E, Tkachev S, Chow P, Xiao Y. High-pressure studies of melamine High Pressure Research. 30: 65-71. DOI: 10.1080/08957951003629854 |
0.344 |
|
| 2010 |
Weck PF, Kim E, Czerwinski KR. First-principles study of the hexahalogenotechnetate(IV) ions TcX62 - [X = Cl, Br] Chemical Physics Letters. 487: 190-193. DOI: 10.1016/J.Cplett.2010.01.043 |
0.344 |
|
| 2009 |
Weck PF, Kim E, Poineau F, Czerwinski KR. Structural evolution and properties of subnanometer Tc(n) (n = 2-15) clusters. Physical Chemistry Chemical Physics : Pccp. 11: 10003-8. PMID 19865752 DOI: 10.1039/B914610E |
0.32 |
|
| 2009 |
Weck PF, Kim E, Poineau F, Rodriguez EE, Sattelberger AP, Czerwinski KR. Technetium(IV) halides predicted from first-principles. Inorganic Chemistry. 48: 6555-8. PMID 19537760 DOI: 10.1021/Ic900476M |
0.316 |
|
| 2009 |
Tkachev SN, Pravica M, Kim E, Weck PF. Raman spectroscopic study of cyclopentane at high pressure. The Journal of Chemical Physics. 130: 204505. PMID 19485455 DOI: 10.1063/1.3137075 |
0.359 |
|
| 2009 |
Kumar RS, Rekhi S, Prabhakaran D, Somayazulu M, Kim E, Cook JD, Stemmler T, Boothroyd AT, Chance MR, Cornelius AL. Structural studies on Na0.75CoO2 thermoelectric material at high pressures Solid State Communications. 149: 1712-1716. DOI: 10.1016/J.Ssc.2009.06.012 |
0.378 |
|
| 2009 |
Weck PF, Gobin C, Kim E, Pravica MG. Organic cyclic difluoramino-nitramines: infrared and Raman spectroscopy of 3,3,7,7-tetrakis(difluoramino)octahydro 1,5-dinitro-1,5-diazocine (HNFX) Journal of Raman Spectroscopy. 40: 964-971. DOI: 10.1002/Jrs.2210 |
0.371 |
|
| 2008 |
Tkachev SN, Pravica M, Kim E, Romano E, Weck PF. High-pressure studies of 1,3,5,7-cyclooctatetraene: experiment and theory. The Journal of Physical Chemistry. A. 112: 11501-7. PMID 18928266 DOI: 10.1021/Jp806968C |
0.347 |
|
| 2008 |
Weck PF, Kim E, Lepp SH, Balakrishnan N, Sadeghpour HR. Dimer-induced stabilization of H adsorbate cluster on BN(0001) surface. Physical Chemistry Chemical Physics : Pccp. 10: 5184-7. PMID 18728857 DOI: 10.1039/B809081P |
0.307 |
|
| 2008 |
Miller GP, Kintigh J, Kim E, Weck PF, Berber S, Tomanek D. Hydrogenation of single-wall carbon nanotubes using polyamine reagents: combined experimental and theoretical study. Journal of the American Chemical Society. 130: 2296-303. PMID 18220395 DOI: 10.1021/Ja0775366 |
0.33 |
|
| 2008 |
Kim E, Weck PF, Balakrishnan N, Bae C. Nanoscale building blocks for the development of novel proton exchange membrane fuel cells. The Journal of Physical Chemistry. B. 112: 3283-6. PMID 18198863 DOI: 10.1021/Jp711568F |
0.321 |
|
| 2008 |
Kim E, Weck PF, Berber S, Tománek D. Mechanism of fullerene hydrogenation by polyamines:Ab initiodensity functional calculations Physical Review B. 78. DOI: 10.1103/Physrevb.78.113404 |
0.355 |
|
| 2008 |
Kumar RS, Kim E, Cornelius AL. Structural phase transitions in the potential hydrogen storage compound KBH4 under compression Journal of Physical Chemistry C. 112: 8452-8457. DOI: 10.1021/Jp0765042 |
0.367 |
|
| 2007 |
Kim E, Kumar R, Weck PF, Cornelius AL, Nicol M, Vogel SC, Zhang J, Hartl M, Stowe AC, Daemen L, Zhao Y. Pressure-driven phase transitions in NaBH4: theory and experiments. The Journal of Physical Chemistry. B. 111: 13873-6. PMID 18031032 DOI: 10.1021/Jp709840W |
0.363 |
|
| 2007 |
Tschauner O, Kiefer B, Lee Y, Pravica M, Nicol M, Kim E. Structural transition of PETN-I to ferroelastic orthorhombic phase PETN-III at elevated pressures. Journal of Chemical Physics. 127: 94502. PMID 17824743 DOI: 10.1063/1.2769357 |
0.339 |
|
| 2007 |
Weck PF, Dhilip Kumar TJ, Kim E, Balakrishnan N. Computational study of hydrogen storage in organometallic compounds. The Journal of Chemical Physics. 126: 094703. PMID 17362114 DOI: 10.1063/1.2710264 |
0.308 |
|
| 2007 |
Kim E, Pang T, Utsumi W, Solozhenko VL, Zhao Y. Cubic phases of B C 2 N : A first-principles study Physical Review B. 75: 184115. DOI: 10.1103/Physrevb.75.184115 |
0.365 |
|
| 2007 |
Kumar RS, Kim E, Tschauner O, Cornelius AL, Sulic MP, Jensen CM. Pressure-induced structural phase transition in NaAl H4 Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.174110 |
0.348 |
|
| 2007 |
Weck PF, Kim E, Balakrishnan N, Poineau F, Yeamans CB, Czerwinski KR. First-principles study of single-crystal uranium mono- and dinitride Chemical Physics Letters. 443: 82-86. DOI: 10.1016/J.Cplett.2007.06.047 |
0.372 |
|
| 2007 |
Weck PF, Kim E, Balakrishnan N, Cheng H, Yakobson BI. Designing carbon nanoframeworks tailored for hydrogen storage Chemical Physics Letters. 439: 354-359. DOI: 10.1016/J.Cplett.2007.03.101 |
0.363 |
|
| 2006 |
Kim E, Nicol M, Cynn H, Yoo CS. Martensitic fcc-to-hcp transformations in solid xenon under pressure: a first-principles study. Physical Review Letters. 96: 035504. PMID 16486725 DOI: 10.1103/Physrevlett.96.035504 |
0.303 |
|
| 2004 |
Kim E, Chen C. Calculation of bulk modulus for highly anisotropic materials Physics Letters A. 326: 442-448. DOI: 10.1016/J.Physleta.2004.04.053 |
0.381 |
|
| 2003 |
Kim E, Chen C. First-principles study of phase stability of BN under pressure Physics Letters A. 319: 384-389. DOI: 10.1016/J.Physleta.2003.10.052 |
0.373 |
|
| 2002 |
Lee SM, Kim E, Lee YH. Dimer-Exchange Mechanism in Surfactant-Mediated Si/Ge Epitaxial Growth Journal of Physical Chemistry B. 106: 891-894. DOI: 10.1021/Jp0116555 |
0.412 |
|
| 2002 |
Kim E, Chen C. Distribution of dimer vacancy lines on Si(001) Physics Letters A. 301: 484-489. DOI: 10.1016/S0375-9601(02)01039-3 |
0.329 |
|
| 2001 |
Kim E, Chen C, Köhler T, Elstner M, Frauenheim T. Tetragonal crystalline carbon nitrides: theoretical predictions. Physical Review Letters. 86: 652-655. PMID 11177904 DOI: 10.1103/Physrevlett.86.652 |
0.368 |
|
| 2001 |
Kim E, Chen C, Köhler T, Elstner M, Frauenheim T. Theoretical study of a body-centered-tetragonal phase of carbon nitride Physical Review B. 64: 94107. DOI: 10.1103/Physrevb.64.094107 |
0.363 |
|
| 2001 |
Kim E, Chen C. Stability of tetragonal crystalline carbon nitrides: the nitrogen content dependence Physics Letters A. 282: 415-420. DOI: 10.1016/S0375-9601(01)00200-6 |
0.328 |
|
| 1999 |
Kim E, Chen C, Pang T, Lee YH. Ordering Of Dimer Vacancies On The Si(100) Surface Physical Review B. 60: 8680-8685. DOI: 10.1103/Physrevb.60.8680 |
0.416 |
|
| 1999 |
Kim E, Lee YH, Chen C, Pang T. Vacancies in amorphous silicon: A tight-binding molecular-dynamics simulation Physical Review B. 59: 2713-2721. DOI: 10.1103/Physrevb.59.2713 |
0.442 |
|
| 1997 |
Kim E, Lee SM, Lee YH. Transferable Tight-Binding Approach Of Si-H Interactions Mrs Proceedings. 491: 347. DOI: 10.1557/Proc-491-347 |
0.426 |
|
| 1997 |
Kim E, Lee YH, Chen C, Pang T. Structural relaxation of vacancies in amorphous silicon Mrs Proceedings. 467. DOI: 10.1557/Proc-467-555 |
0.428 |
|
| 1997 |
Kim E, Oh CW, Lee YH. Diffusion Mechanism Of Si Adatoms On A Double-Layer Stepped Si(001) Surface Physical Review Letters. 79: 4621-4624. DOI: 10.1103/Physrevlett.79.4621 |
0.359 |
|
| 1997 |
Kim E, Lee YH, Chen C, Pang T. Structural And Vibrational Properties Of Amorphous Si1-Xgex Alloys : An Abinitio Molecular-Dynamics Study Physical Review B. 56: 10200-10207. DOI: 10.1103/Physrevb.56.10200 |
0.405 |
|
| 1996 |
Oh CW, Kim E, Lee YH. Kinetic role of a surfactant in island formation. Physical Review Letters. 76: 776-779. PMID 10061547 DOI: 10.1103/Physrevlett.76.776 |
0.366 |
|
| 1996 |
Kim E, Oh CW, Lee YH. Surfactant-Mediated Si/Ge Epitaxial Crystal Growth Mrs Proceedings. 448: 135. DOI: 10.1557/Proc-448-135 |
0.403 |
|
| 1995 |
Kim E, Lee YH. Phase separation of Si1-xGex alloys Mrs Proceedings. 378. DOI: 10.1557/Proc-378-1031 |
0.367 |
|
| 1995 |
Kim E, Oh D-, Oh CW, Lee YH. Fragmentation of C60, C70 by tight-binding molecular-dynamics approach Synthetic Metals. 70: 1495-1498. DOI: 10.1016/0379-6779(94)02932-O |
0.387 |
|
| 1994 |
Kim E, Lee YH, Lee JM. Transferable tight-binding model for hydrogen-silicon interactions Journal of Physics: Condensed Matter. 6: 9561-9570. DOI: 10.1088/0953-8984/6/45/007 |
0.406 |
|
| 1992 |
Kim E, Lee KH, Lee HJ, Lee YH. Structural stability and vibrational properties of hydrogen complexes in silicon Journal of Physics: Condensed Matter. 4: 6443-6450. DOI: 10.1088/0953-8984/4/30/010 |
0.429 |
|
| 1992 |
Woo S, Lee SH, Kim E, Lee K, Lee YH, Hwang SY, Jeon IC. Bulk modulus of the C60 molecule via the tight binding method Physics Letters A. 162: 501-505. DOI: 10.1016/0375-9601(92)90014-D |
0.435 |
|
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