Year |
Citation |
Score |
2019 |
Byun YM, Öğüt S. Practical GW scheme for electronic structure of 3d-transition-metal monoxide anions: ScO, TiO, CuO, and ZnO. The Journal of Chemical Physics. 151: 134305. PMID 31594362 DOI: 10.1063/1.5118671 |
0.339 |
|
2018 |
Shi B, Weissman S, Bruneval F, Kronik L, Öğüt S. Photoelectron spectra of copper oxide cluster anions from first principles methods. The Journal of Chemical Physics. 149: 064306. PMID 30111139 DOI: 10.1063/1.5038744 |
0.306 |
|
2018 |
Gao W, Hung L, Ogut S, Chelikowsky JR. The stability, electronic structure, and optical absorption of boron-nitride diamondoids predicted with first-principles calculations. Physical Chemistry Chemical Physics : Pccp. PMID 29978876 DOI: 10.1039/C8Cp02377H |
0.408 |
|
2017 |
Hung L, Bruneval F, Baishya K, Öğüt S. Correction to Benchmarking the GW Approximation and Bethe-Salpeter Equation for Groups IB and IIB Monoxides. Journal of Chemical Theory and Computation. PMID 29099593 DOI: 10.1021/Acs.Jctc.7B01054 |
0.704 |
|
2017 |
Hung L, Bruneval F, Baishya K, Öğüt S. Benchmarking the GW Approximation and Bethe-Salpeter Equation for Groups IB and IIB Atoms and Monoxides. Journal of Chemical Theory and Computation. PMID 28387124 DOI: 10.1021/Acs.Jctc.7B00123 |
0.753 |
|
2017 |
Hong L, Bhatnagar K, Droopad R, Klie RF, Öğüt S. Atomic-scale structural and electronic properties of
SrTiO3/GaAs
interfaces: A combined STEM-EELS and first-principles study Physical Review B. 96. DOI: 10.1103/Physrevb.96.035311 |
0.343 |
|
2016 |
Hung L, da Jornada FH, Souto-Casares J, Chelikowsky JR, Louie SG, Öğüt S. Excitation spectra of aromatic molecules within a real-spaceGW-BSE formalism: Role of self-consistency and vertex corrections Physical Review B. 94. DOI: 10.1103/Physrevb.94.085125 |
0.355 |
|
2016 |
Hu X, Phillips PJ, Mazumdar D, Idrobo JC, Kolesnik S, Gupta A, Ogut S, Klie RF. Atomic and electronic structure of Ti substitution in Ca3Co4O9 Journal of Applied Physics. 120: 205105. DOI: 10.1063/1.4966938 |
0.385 |
|
2015 |
Qiao Q, Zhang Y, Contreras-Guerrero R, Droopad R, Pantelides ST, Pennycook SJ, Ogut S, Klie RF. Direct observation of oxygen-vacancy-enhanced polarization in a SrTiO3-buffered ferroelectric BaTiO3 film on GaAs Applied Physics Letters. 107. DOI: 10.1063/1.4936159 |
0.303 |
|
2015 |
Hong L, Ögüt S, Klie R. Transmission Electron Microscopic and First-principles Study of SrTiO3/GaAs Hetero-interfaces Microscopy and Microanalysis. 21: 1647-1648. DOI: 10.1017/S1431927615009010 |
0.316 |
|
2013 |
Rébola A, Fong DD, Eastman JA, Öǧüt S, Zapol P. First-principles study of compensation mechanisms in negatively charged LaGaO3/MgAl2O4 interfaces Physical Review B - Condensed Matter and Materials Physics. 87. DOI: 10.1103/Physrevb.87.245117 |
0.733 |
|
2012 |
Klie RF, Qiao Q, Paulauskas T, Gulec A, Rebola A, Öğüt S, Prange MP, Idrobo JC, Pantelides ST, Kolesnik S, Dabrowski B, Ozdemir M, Boyraz C, Mazumdar D, Gupta A. Observations of Co4+ in a higher spin state and the increase in the Seebeck coefficient of thermoelectric Ca3Co4O9. Physical Review Letters. 108: 196601. PMID 23003068 DOI: 10.1103/Physrevlett.108.196601 |
0.313 |
|
2012 |
Idrobo JC, Walkosz W, Klie RF, Oğüt S. Identification of light elements in silicon nitride by aberration-corrected scanning transmission electron microscopy. Ultramicroscopy. 123: 74-9. PMID 22726263 DOI: 10.1016/J.Ultramic.2012.05.008 |
0.347 |
|
2012 |
Rébola A, Klie R, Zapol P, Öğüt S. First-principles study of the atomic and electronic structures of misfit-layered calcium cobaltite (Ca2CoO3)(CoO2)1.62using rational approximants Physical Review B. 85. DOI: 10.1103/Physrevb.85.155132 |
0.746 |
|
2012 |
Qiao Q, Ogut S, Klie R. Low kV Analysis of the Atomic Structure and Bonding at Complex Oxide - Semiconductor Hetero-interfaces Microscopy and Microanalysis. 18: 1626-1627. DOI: 10.1017/S1431927612009981 |
0.303 |
|
2011 |
Baishya K, Idrobo JC, Öǧüt S, Yang M, Jackson KA, Jellinek J. First-principles absorption spectra of Cun (n=2-20) clusters Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.245402 |
0.754 |
|
2010 |
Walkosz W, Klie RF, Öǧüt S, Mikijelj B, Pennycook SJ, Pantelides ST, Idrobo JC. Crystal-induced effects at crystal/amorphous interfaces: The case of Si3N4/SiO2 Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.081412 |
0.358 |
|
2010 |
Qiao Q, Klie R, Ogut S. Atomic and Electronic Structure of SrTiO3/GaAs Hetero-Interfaces Microscopy and Microanalysis. 16: 1422-1423. DOI: 10.1017/S143192761006099X |
0.361 |
|
2009 |
Frey K, Idrobo JC, Tiago ML, Reboredo F, Öǧüt S. Quasiparticle gaps and exciton Coulomb energies in Si nanoshells: First-principles calculations Physical Review B - Condensed Matter and Materials Physics. 80. DOI: 10.1103/Physrevb.80.153411 |
0.336 |
|
2009 |
Idrobo JC, Oxley MP, Walkosz W, Klie RF, Öǧüt S, Mikijelj B, Pennycook SJ, Pantelides ST. Identification and lattice location of oxygen impurities in α-Si 3 N4 Applied Physics Letters. 95. DOI: 10.1063/1.3250922 |
0.327 |
|
2009 |
Walkosz W, Klie RF, Öǧüt S, Mikijelj B, Becher P, Borisevich AY, Pennycook SJ, Idrobo JC. Study of the atomic structures of Si3N4/CeO 2-δand Si3N4/SiO2 interfaces using STEM and first-principles methods Microscopy and Microanalysis. 15: 1014-1015. DOI: 10.1017/S1431927609095555 |
0.307 |
|
2008 |
Walkosz W, Idrobo JC, Klie RF, Öǧüt S. Reconstructions and nonstoichiometry of oxygenated β -Si 3N4 (101̄0) surfaces Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.165322 |
0.368 |
|
2008 |
Baishya K, Idrobo JC, Öǧüt S, Yang M, Jackson K, Jellinek J. Optical absorption spectra of intermediate-size silver clusters from first principles Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.075439 |
0.754 |
|
2008 |
Idrobo JC, Walkosz W, Yip SF, Öğüt S, Wang J, Jellinek J. Erratum: Static polarizabilities and optical absorption spectra of gold clusters (Aun,n=2−14and 20) from first principles [Phys. Rev. B76, 205422 (2007)] Physical Review B. 77. DOI: 10.1103/Physrevb.77.249903 |
0.32 |
|
2008 |
Idrobo JC, Öğüt S, Jellinek J. Erratum: Size dependence of the static polarizabilities and absorption spectra ofAgn(n=2−8)clusters [Phys. Rev. B72, 085445 (2005)] Physical Review B. 77. DOI: 10.1103/Physrevb.77.239901 |
0.31 |
|
2008 |
Walkosz W, Klie RF, Öǧüt S, Borisevich A, Becher PF, Pennycook SJ, Idrobo JC. Atomic resolution study of the interfacial bonding at Si3 N4 / CeO2-δ grain boundaries Applied Physics Letters. 93. DOI: 10.1063/1.2968683 |
0.387 |
|
2007 |
Idrobo JC, Walkosz W, Yip SF, Öǧüt S, Wang J, Jellinek J. Static polarizabilities and optical absorption spectra of gold clusters (Aun, n=2-14 and 20) from first principles Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.205422 |
0.433 |
|
2007 |
Idrobo JC, Öǧüt S, Nemeth K, Jellinek J, Ferrando R. First-principles isomer-specific absorption spectra of Ag11 Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.233411 |
0.419 |
|
2007 |
Iddir H, Öǧüt S, Zapol P, Browning ND. Diffusion mechanisms of native point defects in rutile Ti O2: Ab initio total-energy calculations Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.073203 |
0.657 |
|
2007 |
Iddir H, Komanicky V, Öǧüt S, Hoydoo Y, Zapol P. Shape of platinum nanoparticles supported on SrTiO 3: Experiment and theory Journal of Physical Chemistry C. 111: 14782-14789. DOI: 10.1021/Jp073041R |
0.635 |
|
2006 |
Idrobo JC, Yang M, Jackson KA, Öǧüt S. First-principles absorption spectra of Sin (n=20-28) clusters: Time-dependent local-density approximation versus predictions from Mie theory Physical Review B - Condensed Matter and Materials Physics. 74. DOI: 10.1103/Physrevb.74.153410 |
0.393 |
|
2006 |
Iddir H, Öğüt S, Browning ND, Disko MM. Erratum: Adsorption and diffusion of Pt and Au on the stoichiometric and reducedTiO2rutile (110) surfaces [Phys. Rev. B72, 081407(R) (2005)] Physical Review B. 73. DOI: 10.1103/Physrevb.73.039902 |
0.609 |
|
2006 |
Arslan I, Bleloch A, Stach EA, Ogut S, Browning ND. Using EELS to observe composition and electronic structure variations at dislocation cores in GaN Philosophical Magazine. 86: 4727-4746. DOI: 10.1080/14786430600740641 |
0.369 |
|
2006 |
Öǧüt S, Idrobo JC, Jellinek J, Wang J. Structural, electronic, and optical properties of noble metal clusters from first principles Journal of Cluster Science. 17: 609-626. DOI: 10.1007/S10876-006-0075-8 |
0.373 |
|
2005 |
Iddir H, Disko MM, Ogut S, Browning ND. Atomic scale characterization of the Pt/TiO2 interface. Micron (Oxford, England : 1993). 36: 233-41. PMID 15725592 DOI: 10.1016/J.Micron.2004.12.002 |
0.637 |
|
2005 |
Idrobo JC, Iddir H, Ögüt S, Ziegler A, Browning ND, Ritchie RO. Ab initio structural energetics of β-Si3N4 surfaces Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.241301 |
0.663 |
|
2005 |
Idrobo JC, Öǧüt S, Jellinek J. Size dependence of the static polarizabilities and absorption spectra of Agn (n=2-8) clusters Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.085445 |
0.416 |
|
2005 |
Iddir H, Öǧüt S, Browning ND, Disko MM. Adsorption and diffusion of Pt and Au on the stoichiometric and reduced Ti O2 rutile (110) surfaces Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.081407 |
0.642 |
|
2005 |
Ciani AJ, Ogut S, Batra IP, Sivananthan S. Diffusion of gold and native defects in mercury cadmium telluride Journal of Electronic Materials. 34: 868-872. DOI: 10.1007/S11664-005-0034-4 |
0.744 |
|
2004 |
Idrobo JC, Ögüt S, Yildirim T, Klie RF, Browning ND. Electronic and superconducting properties of oxygen-ordered MgB2 compounds of the form Mg2B3Ox Physical Review B - Condensed Matter and Materials Physics. 70: 1-4. DOI: 10.1103/Physrevb.70.172503 |
0.363 |
|
2004 |
Buban JP, Iddir H, Öǧüt S. Structural and electronic properties of oxygen vacancies in cubic and antiferrodistortive phases of SrTiO3 Physical Review B - Condensed Matter and Materials Physics. 69. DOI: 10.1103/Physrevb.69.180102 |
0.659 |
|
2004 |
Iddir H, Disko MM, Browning ND, Ogut S. Atomic scale characterization of the Pt/TiO2 interface Microscopy and Microanalysis. 10: 452-453. DOI: 10.1017/S1431927604882412 |
0.625 |
|
2004 |
Ciani AJ, Ogut S, Batra IP. Concentrations of native and gold defects in HgCdTe from first principles calculations Journal of Electronic Materials. 33: 737-741. DOI: 10.1007/S11664-004-0075-0 |
0.744 |
|
2003 |
Oğüt S, Chelikowsky JR. Charge state dependent Jahn-Teller distortions of the e-center defect in crystalline Si. Physical Review Letters. 91: 235503. PMID 14683194 DOI: 10.1103/Physrevlett.91.235503 |
0.392 |
|
2003 |
Arslan I, Ogut S, Nellist PD, Browning ND. Comparison of simulation methods for electronic structure calculations with experimental electron energy-loss spectra. Micron (Oxford, England : 1993). 34: 255-60. PMID 12895498 DOI: 10.1016/S0968-4328(03)00036-2 |
0.369 |
|
2003 |
Natarajan R, Öğüt S. Structural and electronic properties of Ge-Te clusters Physical Review B. 67. DOI: 10.1103/Physrevb.67.235326 |
0.401 |
|
2002 |
Vasiliev I, Öğüt S, Chelikowsky JR. First-principles density-functional calculations for optical spectra of clusters and nanocrystals Physical Review B. 65. DOI: 10.1103/Physrevb.65.115416 |
0.413 |
|
2001 |
Vasiliev I, Öǧüt S, Chelikowsky JR. Ab initio absorption spectra and optical gaps in nanocrystalline silicon Physical Review Letters. 86: 1813-1816. DOI: 10.1103/Physrevlett.86.1813 |
0.392 |
|
2001 |
Öğüt S, Chelikowsky JR. Ab initioinvestigation of point defects in bulk Si and Ge using a cluster method Physical Review B. 64. DOI: 10.1103/Physrevb.64.245206 |
0.429 |
|
2000 |
Müller J, Liu B, Shvartsburg AA, Ogut S, Chelikowsky JR, Siu KWM, Ho KM, Gantefor G. Spectroscopic evidence for the tricapped trigonal prism structure of semiconductor clusters Physical Review Letters. 85: 1666-1669. DOI: 10.1103/Physrevlett.85.1666 |
0.373 |
|
1999 |
Ögüt S, Chelikowsky JR, Louie SG. Optical Properties of Silicon Nanocrystals: A First Principles Study Mrs Proceedings. 579. DOI: 10.1557/Proc-579-81 |
0.4 |
|
1999 |
Öğüt S, Chelikowsky JR. Large Pairing Jahn-Teller Distortions Around Divacancies in Crystalline Silicon Physical Review Letters. 83: 3852-3855. DOI: 10.1103/Physrevlett.83.3852 |
0.399 |
|
1999 |
Vasiliev I, Öğüt S, Chelikowsky JR. Ab InitioExcitation Spectra and Collective Electronic Response in Atoms and Clusters Physical Review Letters. 82: 1919-1922. DOI: 10.1103/Physrevlett.82.1919 |
0.36 |
|
1997 |
Öğüt S, Chelikowsky JR, Louie SG. Quantum Confinement and Optical Gaps in Si Nanocrystals Physical Review Letters. 79: 1770-1773. DOI: 10.1103/Physrevlett.79.1770 |
0.369 |
|
1997 |
Öğüt S, Kim H, Chelikowsky JR. Ab initiocluster calculations for vacancies in bulk Si Physical Review B. 56: R11353-R11356. DOI: 10.1103/Physrevb.56.R11353 |
0.333 |
|
1996 |
Öğüt S, Rabe KM. Anomalous effective charges and far-IR optical absorption of Al2Ru from first principles. Physical Review B. 54: 8297-8300. PMID 9984579 DOI: 10.1103/Physrevb.54.R8297 |
0.34 |
|
1995 |
Chelikowsky JR, ÖĞüt S, Jingc X, Wu K, Stathopoulos A, Saad Y. Atomic and Electronic Structure of Germanium Clusters at Finite Temperature Using Finite Difference Methods Mrs Proceedings. 408. DOI: 10.1557/Proc-408-19 |
0.356 |
|
1995 |
Öǧüt S, Rabe KM. Polymorphism and metastability in NbN: Structural predictions from first principles Physical Review B. 52. DOI: 10.1103/Physrevb.52.R8585 |
0.356 |
|
1994 |
Ogut S, Rabe KM. Ab initio pseudopotential calculations for aluminum-rich cobalt compounds Physical Review B. 50: 2075-2084. DOI: 10.1103/Physrevb.50.2075 |
0.366 |
|
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