| Year |
Citation |
Score |
| 2023 |
Salem M, Loevlie DJ, Mpourmpakis G. Single Atom Alloys Segregation in the Presence of Ligands. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 127: 22790-22798. PMID 38037638 DOI: 10.1021/acs.jpcc.3c05827 |
0.3 |
|
| 2023 |
Tang W, Yang T, Morales-Rivera CA, Geng X, Srirambhatla VK, Kang X, Chauhan VP, Hong S, Tu Q, Florence AJ, Mo H, Calderon HA, Kisielowski C, Hernandez FCR, Zou X, ... Mpourmpakis G, et al. Tautomerism unveils a self-inhibition mechanism of crystallization. Nature Communications. 14: 561. PMID 36732334 DOI: 10.1038/s41467-023-35924-3 |
0.746 |
|
| 2023 |
Hong S, Mallette AJ, Neeway JJ, Motkuri RK, Rimer JD, Mpourmpakis G. Understanding formation thermodynamics of structurally diverse zeolite oligomers with first principles calculations. Dalton Transactions (Cambridge, England : 2003). PMID 36625388 DOI: 10.1039/d2dt02764j |
0.784 |
|
| 2022 |
Mallette AJ, Hong S, Freeman EE, Saslow SA, Mergelsberg S, Motkuri RK, Neeway JJ, Mpourmpakis G, Rimer JD. Heteroatom Manipulation of Zeolite Crystallization: Stabilizing Zn-FAU against Interzeolite Transformation. Jacs Au. 2: 2295-2306. PMID 36311839 DOI: 10.1021/jacsau.2c00325 |
0.774 |
|
| 2022 |
Li S, Nagarajan AV, Du X, Li Y, Liu Z, Kauffman DR, Mpourmpakis G, Jin R. Dissecting Critical Factors for Electrochemical CO Reduction on Atomically Precise Au Nanoclusters. Angewandte Chemie (International Ed. in English). e202211771. PMID 36283972 DOI: 10.1002/anie.202211771 |
0.617 |
|
| 2022 |
Salem M, Cowan MJ, Mpourmpakis G. Predicting Segregation Energy in Single Atom Alloys Using Physics and Machine Learning. Acs Omega. 7: 4471-4481. PMID 35155939 DOI: 10.1021/acsomega.1c06337 |
0.771 |
|
| 2021 |
Dean J, Yang Y, Veser G, Mpourmpakis G. CuZrO: If it exists it should be a sandwich. Physical Chemistry Chemical Physics : Pccp. PMID 34643191 DOI: 10.1039/d1cp02245h |
0.755 |
|
| 2021 |
Li Y, Li S, Nagarajan AV, Liu Z, Nevins S, Song Y, Mpourmpakis G, Jin R. Hydrogen Evolution Electrocatalyst Design: Turning Inert Gold into Active Catalyst by Atomically Precise Nanochemistry. Journal of the American Chemical Society. PMID 34270239 DOI: 10.1021/jacs.1c04606 |
0.644 |
|
| 2021 |
Cowan MJ, Nagarajan AV, Mpourmpakis G. Correlating structural rules with electronic properties of ligand-protected alloy nanoclusters. The Journal of Chemical Physics. 155: 024303. PMID 34266280 DOI: 10.1063/5.0056690 |
0.799 |
|
| 2021 |
Li S, Nagarajan AV, Li Y, Kauffman DR, Mpourmpakis G, Jin R. The role of ligands in atomically precise nanocluster-catalyzed CO electrochemical reduction. Nanoscale. PMID 33464267 DOI: 10.1039/d0nr07832h |
0.631 |
|
| 2021 |
McKay J, Cowan MJ, Morales-Rivera CA, Mpourmpakis G. Predicting ligand removal energetics in thiolate-protected nanoclusters from molecular complexes. Nanoscale. PMID 33449990 DOI: 10.1039/d0nr07839e |
0.761 |
|
| 2020 |
Li W, Taylor MG, Bayerl D, Mozaffari S, Dixit M, Ivanov S, Seifert S, Lee B, Shanaiah N, Lu Y, Kovarik L, Mpourmpakis G, Karim AM. Solvent manipulation of the pre-reduction metal-ligand complex and particle-ligand binding for controlled synthesis of Pd nanoparticles. Nanoscale. PMID 33325939 DOI: 10.1039/d0nr06078j |
0.687 |
|
| 2020 |
Li Y, Cowan MJ, Zhou M, Luo TY, Song Y, Wang H, Rosi NL, Mpourmpakis G, Jin R. Atom-by-Atom Evolution of the Same Ligand-Protected Au, Au, AuCd, and Au Nanocluster Series. Journal of the American Chemical Society. PMID 33170677 DOI: 10.1021/jacs.0c09110 |
0.752 |
|
| 2020 |
Miu E, Mpourmpakis G, McKone JR. Predicting the Energetics of Hydrogen Intercalation in Metal Oxides Using Acid-Base Properties. Acs Applied Materials & Interfaces. PMID 32929950 DOI: 10.1021/Acsami.0C11300 |
0.364 |
|
| 2020 |
Li Y, Taylor MG, Luo TY, Song Y, Rosi NL, Mpourmpakis G, Jin R. Heteroatom Tracing Reveals the 30-Atom Au-Ag Bimetallic Nanocluster as a Dimeric Structure. The Journal of Physical Chemistry Letters. PMID 32787300 DOI: 10.1021/Acs.Jpclett.0C01977 |
0.545 |
|
| 2020 |
Cowan MJ, Mpourmpakis G. Towards elucidating structure of ligand-protected nanoclusters. Dalton Transactions (Cambridge, England : 2003). 49: 9191-9202. PMID 32678402 DOI: 10.1039/D0Dt01418D |
0.769 |
|
| 2020 |
Dean J, Cowan MJ, Estes J, Ramadan M, Mpourmpakis G. Rapid Prediction of Bimetallic Mixing Behavior at the Nanoscale. Acs Nano. PMID 32515581 DOI: 10.1021/Acsnano.0C01586 |
0.787 |
|
| 2020 |
Li Y, Juarez-Mosqueda R, Song Y, Zhang Y, Chai J, Mpourmpakis G, Jin R. Ligand exchange on Au(SR): substituent site effects of aromatic thiols. Nanoscale. PMID 32323691 DOI: 10.1039/D0Nr01430C |
0.403 |
|
| 2020 |
Li Y, Cowan MJ, Zhou M, Taylor MG, Wang H, Song Y, Mpourmpakis G, Jin R. Heterometal-Doped M23 (M=Au/Ag/Cd) Nanoclusters with Large Dipole Moments. Acs Nano. PMID 32286795 DOI: 10.1021/Acsnano.0C01000 |
0.779 |
|
| 2020 |
Juneau M, Vonglis M, Hartvigsen J, Frost L, Bayerl D, Dixit M, Mpourmpakis G, Morse JR, Baldwin JW, Willauer HD, Porosoff MD. Assessing the viability of K-Mo2C for reverse water–gas shift scale-up: molecular to laboratory to pilot scale Energy & Environmental Science. 13: 2524-2539. DOI: 10.1039/D0Ee01457E |
0.558 |
|
| 2020 |
Abdelgaid M, Dean JR, Mpourmpakis G. Improving Alkane Dehydrogenation Activity on γ-Al2O3 through Ga Doping Catalysis Science & Technology. DOI: 10.1039/D0Cy01474E |
0.728 |
|
| 2020 |
Li S, Alfonso D, Nagarajan AV, House SD, Yang JC, Kauffman DR, Mpourmpakis G, Jin R. Mono-Palladium Substitution in Gold Nanoclusters Enhances CO2 Electroreduction Activity and Selectivity Acs Catalysis. DOI: 10.1021/Acscatal.0C02266 |
0.635 |
|
| 2020 |
Cheula R, Maestri M, Mpourmpakis G. Modeling Morphology and Catalytic Activity of Nanoparticle Ensembles Under Reaction Conditions Acs Catalysis. 10: 6149-6158. DOI: 10.1021/Acscatal.0C01005 |
0.325 |
|
| 2020 |
Nagarajan AV, Juarez-Mosqueda R, Cowan MJ, Jin R, Kauffman DR, Mpourmpakis G. Elucidating the stability of ligand-protected Au nanoclusters under electrochemical reduction of CO2 Sn Applied Sciences. 2. DOI: 10.1007/s42452-020-2488-7 |
0.78 |
|
| 2019 |
Mozaffari S, Li W, Dixit M, Seifert S, Lee B, Kovarik L, Mpourmpakis G, Karim AM. The role of nanoparticle size and ligand coverage in size focusing of colloidal metal nanoparticles. Nanoscale Advances. 1: 4052-4066. PMID 36132098 DOI: 10.1039/c9na00348g |
0.554 |
|
| 2019 |
Mozaffari S, Li W, Dixit M, Seifert S, Lee B, Kovarik L, Mpourmpakis G, Karim AM. The role of nanoparticle size and ligand coverage in size focusing of colloidal metal nanoparticles. Nanoscale Advances. 1: 4052-4066. PMID 36132098 DOI: 10.1039/c9na00348g |
0.554 |
|
| 2019 |
Juarez-Mosqueda R, Mpourmpakis G. Elucidating the optical spectra of [Au(SR)] nanoclusters. Physical Chemistry Chemical Physics : Pccp. PMID 31589223 DOI: 10.1039/C9Cp03982A |
0.32 |
|
| 2019 |
Dean J, Taylor MG, Mpourmpakis G. Unfolding adsorption on metal nanoparticles: Connecting stability with catalysis. Science Advances. 5: eaax5101. PMID 31548989 DOI: 10.1126/Sciadv.Aax5101 |
0.796 |
|
| 2019 |
Cowan MJ, Mpourmpakis G. Structure–property relationships on thiolate-protected gold nanoclusters Nanoscale Advances. 1: 184-188. DOI: 10.1039/C8NA00246K |
0.735 |
|
| 2019 |
Cowan MJ, Higaki T, Jin R, Mpourmpakis G. Understanding the Solubility Behavior of Atomically Precise Gold Nanoclusters The Journal of Physical Chemistry C. 123: 20006-20012. DOI: 10.1021/Acs.Jpcc.9B05562 |
0.774 |
|
| 2019 |
Tan K, Dixit M, Dean J, Mpourmpakis G. Predicting Metal–Support Interactions in Oxide-Supported Single-Atom Catalysts Industrial & Engineering Chemistry Research. 58: 20236-20246. DOI: 10.1021/Acs.Iecr.9B04068 |
0.811 |
|
| 2018 |
Cowan MJ, Mpourmpakis G. Structure-property relationships on thiolate-protected gold nanoclusters. Nanoscale Advances. 1: 184-188. PMID 36132447 DOI: 10.1039/c8na00246k |
0.768 |
|
| 2018 |
Cholewinski MC, Dixit M, Mpourmpakis G. Computational Study of Methane Activation on γ-AlO. Acs Omega. 3: 18242-18250. PMID 31458402 DOI: 10.1021/acsomega.8b02554 |
0.562 |
|
| 2018 |
Taylor MG, Mpourmpakis G. Rethinking Heterometal Doping in Ligand-Protected Metal Nanoclusters. The Journal of Physical Chemistry Letters. PMID 30365319 DOI: 10.1021/Acs.Jpclett.8B02679 |
0.589 |
|
| 2018 |
Yan Z, Taylor MG, Mascareno A, Mpourmpakis G. Size, Shape and Composition Dependent Model for Metal Nanoparticle Stability Prediction. Nano Letters. PMID 29578341 DOI: 10.1021/Acs.Nanolett.8B00670 |
0.59 |
|
| 2018 |
Austin N, Kostetskyy P, Mpourmpakis G. Design of highly selective ethanol dehydration nanocatalysts for ethylene production. Nanoscale. PMID 29424847 DOI: 10.1039/C7Nr08678D |
0.792 |
|
| 2018 |
Dean J, Yang Y, Austin N, Veser G, Mpourmpakis G. Designing Cu-based Bimetallic Nanoparticles for CO2 Adsorption and Activation. Chemsuschem. PMID 29377637 DOI: 10.1002/Cssc.201702342 |
0.789 |
|
| 2018 |
Austin N, Zhao S, McKone JR, Jin R, Mpourmpakis G. Elucidating the active sites for CO2 electroreduction on ligand-protected Au25 nanoclusters Catalysis Science & Technology. 8: 3795-3805. DOI: 10.1039/C8Cy01099D |
0.624 |
|
| 2018 |
Dixit M, Kostetskyy P, Mpourmpakis G. Structure–Activity Relationships in Alkane Dehydrogenation on γ-Al2O3: Site-Dependent Reactions Acs Catalysis. 8: 11570-11578. DOI: 10.1021/Acscatal.8B03484 |
0.793 |
|
| 2018 |
Zhao S, Austin N, Li M, Song Y, House SD, Bernhard S, Yang JC, Mpourmpakis G, Jin R. Influence of Atomic-Level Morphology on Catalysis: The Case of Sphere and Rod-Like Gold Nanoclusters for CO2 Electroreduction Acs Catalysis. 8: 4996-5001. DOI: 10.1021/Acscatal.8B00365 |
0.657 |
|
| 2018 |
Teixeira IF, Lo BTW, Kostetskyy P, Ye L, Tang CC, Mpourmpakis G, Tsang SCE. Direct Catalytic Conversion of Biomass-Derived Furan and Ethanol to Ethylbenzene Acs Catalysis. 8: 1843-1850. DOI: 10.1021/Acscatal.7B03952 |
0.766 |
|
| 2018 |
Estes JW, Dixit M, Mpourmpakis G. Understanding the Gas Phase Chemistry of Alkanes with First-Principles Calculations Journal of Chemical & Engineering Data. DOI: 10.1021/Acs.Jced.7B00992 |
0.576 |
|
| 2018 |
Kostetskyy P, Nolan CM, Dixit M, Mpourmpakis G. Understanding Alkane Dehydrogenation through Alcohol Dehydration on γ-Al2O3 Industrial & Engineering Chemistry Research. 57: 16657-16663. DOI: 10.1021/Acs.Iecr.8B04392 |
0.788 |
|
| 2018 |
Chung J, Taylor MG, Granja I, Asplin JR, Mpourmpakis G, Rimer JD. Factors Differentiating the Effectiveness of Polyprotic Acids as Inhibitors of Calcium Oxalate Crystallization in Kidney Stone Disease Crystal Growth & Design. 18: 5617-5627. DOI: 10.1021/Acs.Cgd.8B00945 |
0.666 |
|
| 2018 |
Dean J, Yang Y, Austin N, Veser G, Mpourmpakis G. Cover Feature: Design of Copper-Based Bimetallic Nanoparticles for Carbon Dioxide Adsorption and Activation (ChemSusChem 7/2018) Chemsuschem. 11: 1133-1133. DOI: 10.1002/Cssc.201800592 |
0.778 |
|
| 2017 |
Kallitsakis MG, Tancini PD, Dixit M, Mpourmpakis G, Lykakis IN. Mechanistic studies on the Michael addition of amines and hydrazines to nitrostyrenes: Nitroalkane elimination via a retro-aza-Henry type process. The Journal of Organic Chemistry. PMID 29272119 DOI: 10.1021/Acs.Joc.7B02637 |
0.573 |
|
| 2017 |
Li Q, Lambright KJ, Taylor MG, Kirschbaum K, Luo TY, Zhao J, Mpourmpakis G, Mokashi-Punekar S, Rosi NL, Jin R. Reconstructing the Surface of Gold Nanoclusters by Cadmium Doping. Journal of the American Chemical Society. 139: 17779-17782. PMID 29182284 DOI: 10.1021/Jacs.7B11491 |
0.571 |
|
| 2017 |
Taylor MG, Mpourmpakis G. Thermodynamic stability of ligand-protected metal nanoclusters. Nature Communications. 8: 15988. PMID 28685777 DOI: 10.1038/Ncomms15988 |
0.604 |
|
| 2017 |
Li Q, Taylor MG, Kirschbaum K, Lambright KJ, Zhu X, Mpourmpakis G, Jin R. Site-selective substitution of gold atoms in the Au24(SR)20 nanocluster by silver. Journal of Colloid and Interface Science. PMID 28651820 DOI: 10.1016/J.Jcis.2017.06.049 |
0.578 |
|
| 2017 |
Li Q, Luo TY, Taylor MG, Wang S, Zhu X, Song Y, Mpourmpakis G, Rosi NL, Jin R. Molecular "surgery" on a 23-gold-atom nanoparticle. Science Advances. 3: e1603193. PMID 28560348 DOI: 10.1126/Sciadv.1603193 |
0.591 |
|
| 2017 |
Porosoff MD, Baldwin JW, Peng X, Mpourmpakis G, Willauer HD. Potassium-promoted molybdenum carbide as a highly active and selective catalyst for CO2 conversion to CO. Chemsuschem. PMID 28426923 DOI: 10.1002/Cssc.201700412 |
0.332 |
|
| 2017 |
Dixit M, Peng X, Porosoff MD, Willauer HD, Mpourmpakis G. Elucidating the role of oxygen coverage in CO2 reduction on Mo2C Catalysis Science & Technology. 7: 5521-5529. DOI: 10.1039/C7Cy01810J |
0.575 |
|
| 2017 |
Kostetskyy P, Zervoudis NA, Mpourmpakis G. Carboranes: the strongest Brønsted acids in alcohol dehydration Catalysis Science & Technology. 7: 2001-2011. DOI: 10.1039/C7Cy00458C |
0.741 |
|
| 2017 |
Austin N, Ye J, Mpourmpakis G. CO2 activation on Cu-based Zr-decorated nanoparticles Catalysis Science & Technology. 7: 2245-2251. DOI: 10.1039/C6Cy02628A |
0.615 |
|
| 2017 |
Kostetskyy P, Mpourmpakis G. Computational Insights into Adsorption of C4 Hydrocarbons in Cation-Exchanged ZSM-12 Zeolites Industrial & Engineering Chemistry Research. 56: 7062-7069. DOI: 10.1021/Acs.Iecr.7B00972 |
0.776 |
|
| 2016 |
Chung J, Granja I, Taylor MG, Mpourmpakis G, Asplin JR, Rimer JD. Molecular modifiers reveal a mechanism of pathological crystal growth inhibition. Nature. 1-5. PMID 27501150 DOI: 10.1038/Nature19062 |
0.666 |
|
| 2016 |
Teixeira IF, Lo BT, Kostetskyy P, Stamatakis M, Ye L, Tang CC, Mpourmpakis G, Tsang SC. From Biomass-Derived Furans to Aromatics with Ethanol over Zeolite. Angewandte Chemie (International Ed. in English). PMID 27490584 DOI: 10.1002/Anie.201604108 |
0.777 |
|
| 2016 |
Austin N, Butina B, Mpourmpakis G. CO2 activation on bimetallic CuNi nanoparticles Progress in Natural Science: Materials International. 26: 487-492. DOI: 10.1016/J.Pnsc.2016.08.007 |
0.626 |
|
| 2016 |
Teixeira IF, Lo BTW, Kostetskyy P, Stamatakis M, Ye L, Tang CC, Mpourmpakis G, Tsang SCE. Inside Back Cover: From Biomass-Derived Furans to Aromatics with Ethanol over Zeolite (Angew. Chem. Int. Ed. 42/2016) Angewandte Chemie International Edition. 55: 13349-13349. DOI: 10.1002/Anie.201607477 |
0.759 |
|
| 2016 |
Teixeira IF, Lo BTW, Kostetskyy P, Stamatakis M, Ye L, Tang CC, Mpourmpakis G, Tsang SCE. Innenrücktitelbild: From Biomass-Derived Furans to Aromatics with Ethanol over Zeolite (Angew. Chem. 42/2016) Angewandte Chemie. 128: 13545-13545. DOI: 10.1002/Ange.201607477 |
0.758 |
|
| 2015 |
Marbella LE, Chevrier DM, Tancini PD, Shobayo O, Smith AM, Johnston KA, Andolina CM, Zhang P, Mpourmpakis G, Millstone JE. Description and Role of Bimetallic Prenucleation Species in the Formation of Small Nanoparticle Alloys. Journal of the American Chemical Society. PMID 26670347 DOI: 10.1021/Jacs.5B10124 |
0.369 |
|
| 2015 |
Kostetskyy P, Mpourmpakis G. Structure-activity relationships in the production of olefins from alcohols and ethers: a first-principles theoretical study Catalysis Science & Technology. 5: 4547-4555. DOI: 10.1039/C5Cy00925A |
0.771 |
|
| 2015 |
Nikbin N, Austin N, Vlachos DG, Stamatakis M, Mpourmpakis G. Catalysis at the sub-nanoscale: Complex CO oxidation chemistry on a few Au atoms Catalysis Science and Technology. 5: 134-141. DOI: 10.1039/C4Cy01295J |
0.791 |
|
| 2015 |
Taylor MG, Austin N, Gounaris CE, Mpourmpakis G. Catalyst Design Based on Morphology- and Environment-Dependent Adsorption on Metal Nanoparticles Acs Catalysis. 5: 6296-6301. DOI: 10.1021/Acscatal.5B01696 |
0.715 |
|
| 2015 |
Austin N, Johnson JK, Mpourmpakis G. Au13: CO Adsorbs, Nanoparticle Responds Journal of Physical Chemistry C. 119: 18196-18202. DOI: 10.1021/Acs.Jpcc.5B03459 |
0.631 |
|
| 2015 |
Christiansen MA, Mpourmpakis G, Vlachos DG. DFT-driven multi-site microkinetic modeling of ethanol conversion to ethylene and diethyl ether on γ-Al2O3(1 1 1) Journal of Catalysis. 323: 121-131. DOI: 10.1016/J.Jcat.2014.12.024 |
0.539 |
|
| 2014 |
Andriotis AN, Mpourmpakis G, Broderick S, Rajan K, Datta S, Sunkara M, Menon M. Informatics guided discovery of surface structure-chemistry relationships in catalytic nanoparticles. The Journal of Chemical Physics. 140: 094705. PMID 24606374 DOI: 10.1063/1.4867010 |
0.648 |
|
| 2014 |
Herrmann S, Stamatakis M, Andriotis AN, Mpourmpakis G. Adsorption behavior of noble metal clusters and their alloys Journal of Computational and Theoretical Nanoscience. 11: 511-520. DOI: 10.1166/Jctn.2014.3387 |
0.631 |
|
| 2014 |
Kostestkyy P, Yu J, Gorte RJ, Mpourmpakis G. Structure-activity relationships on metal-oxides: Alcohol dehydration Catalysis Science and Technology. 4: 3861-3869. DOI: 10.1039/C4Cy00632A |
0.346 |
|
| 2014 |
Austin N, Mpourmpakis G. Understanding the Stability and Electronic and Adsorption Properties of Subnanometer Group XI Monometallic and Bimetallic Catalysts The Journal of Physical Chemistry C. 118: 18521-18528. DOI: 10.1021/Jp504015A |
0.649 |
|
| 2013 |
Wang T, Mpourmpakis G, Lonergan WW, Vlachos DG, Chen JG. Effect of oxide supports in stabilizing desirable Pt-Ni bimetallic structures for hydrogenation and reforming reactions. Physical Chemistry Chemical Physics : Pccp. 15: 12156-64. PMID 23689424 DOI: 10.1039/C3Cp44688C |
0.539 |
|
| 2013 |
Christiansen MA, Mpourmpakis G, Vlachos DG. Density Functional Theory-Computed Mechanisms of Ethylene and Diethyl Ether Formation from Ethanol on γ-Al2O3(100) Acs Catalysis. 3: 1965-1975. DOI: 10.1021/Cs4002833 |
0.539 |
|
| 2012 |
Stamatakis M, Christiansen MA, Vlachos DG, Mpourmpakis G. Multiscale modeling reveals poisoning mechanisms of MgO-supported Au clusters in CO oxidation. Nano Letters. 12: 3621-6. PMID 22668206 DOI: 10.1021/Nl301318B |
0.669 |
|
| 2012 |
Roy S, Mpourmpakis G, Hong DY, Vlachos DG, Bhan A, Gorte RJ. Mechanistic study of alcohol dehydration on γ-Al 2O 3 Acs Catalysis. 2: 1846-1853. DOI: 10.1021/Cs300176D |
0.545 |
|
| 2012 |
Courtney TD, Nikolakis V, Mpourmpakis G, Chen JG, Vlachos DG. Liquid-phase dehydration of propylene glycol using solid-acid catalysts Applied Catalysis a: General. 449: 59-68. DOI: 10.1016/J.Apcata.2012.09.034 |
0.534 |
|
| 2012 |
Andriotis AN, Mpourmpakis G, Lisenkov S, Sheetz RM, Menon M. U-calculation of the LSDA + Ufunctional using the hybrid B3LYP and HSE functionals Physica Status Solidi (B). 250: 356-363. DOI: 10.1002/Pssb.201248215 |
0.599 |
|
| 2011 |
Mpourmpakis G, Velegrakis M, Mihesan C, Andriotis AN. Symmetry-switching molecular Fe(O2)n(+) clusters. The Journal of Physical Chemistry. A. 115: 7456-60. PMID 21615142 DOI: 10.1021/Jp204478V |
0.606 |
|
| 2011 |
Nikbin N, Mpourmpakis G, Vlachos DG. A Combined DFT and Statistical Mechanics Study for the CO Oxidation on the Au10–1 Cluster The Journal of Physical Chemistry C. 115: 20192-20200. DOI: 10.1021/Jp206820T |
0.786 |
|
| 2011 |
Mpourmpakis G, Stamatakis M, Herrmann S, Vlachos DG, Andriotis AN. Predicting the adsorption behavior in bulk from metal clusters Chemical Physics Letters. 518: 99-103. DOI: 10.1016/J.Cplett.2011.11.004 |
0.718 |
|
| 2010 |
Mpourmpakis G, Caratzoulas S, Vlachos DG. What controls au nanoparticle dispersity during growth? Nano Letters. 10: 3408-13. PMID 20718479 DOI: 10.1021/Nl101421Q |
0.549 |
|
| 2010 |
Mpourmpakis G, Andriotis AN, Vlachos DG. Identification of descriptors for the CO interaction with metal nanoparticles. Nano Letters. 10: 1041-5. PMID 20151700 DOI: 10.1021/Nl904299C |
0.723 |
|
| 2009 |
Karim AM, Prasad V, Mpourmpakis G, Lonergan WW, Frenkel AI, Chen JG, Vlachos DG. Correlating particle size and shape of supported Ru/gamma-Al2O3 catalysts with NH3 decomposition activity. Journal of the American Chemical Society. 131: 12230-9. PMID 19663478 DOI: 10.1021/Ja902587K |
0.505 |
|
| 2009 |
Mpourmpakis G, Vlachos DG. Growth mechanisms of metal nanoparticles via first principles. Physical Review Letters. 102: 155505. PMID 19518650 DOI: 10.1103/Physrevlett.102.155505 |
0.518 |
|
| 2009 |
Mpourmpakis G, Vlachos DG. The Effects of the MgO Support and Alkali Doping on the CO Interaction with Au The Journal of Physical Chemistry C. 113: 7329-7335. DOI: 10.1021/Jp900198M |
0.566 |
|
| 2008 |
Mpourmpakis G, Froudakis GE. Assessing the density functional theory in the hydrogen storage problem. Journal of Nanoscience and Nanotechnology. 8: 3091-6. PMID 18681051 DOI: 10.1166/Jnn.2008.107 |
0.591 |
|
| 2008 |
Mpourmpakis G, Vlachos DG. Insights into the early stages of metal nanoparticle formation via first-principle calculations: the roles of citrate and water. Langmuir : the Acs Journal of Surfaces and Colloids. 24: 7465-73. PMID 18549294 DOI: 10.1021/La800135S |
0.532 |
|
| 2008 |
Andriotis AN, Mpourmpakis G, Richter E, Menon M. Surface conductivity of hydrogenated diamond films. Physical Review Letters. 100: 106801. PMID 18352217 DOI: 10.1103/Physrevlett.100.106801 |
0.588 |
|
| 2007 |
Mpourmpakis G, Tylianakis E, Froudakis GE. Carbon nanoscrolls: a promising material for hydrogen storage. Nano Letters. 7: 1893-7. PMID 17580924 DOI: 10.1021/Nl070530U |
0.604 |
|
| 2007 |
Mpourmpakis G, Froudakis GE, Lithoxoos GP, Samios J. Effect of curvature and chirality for hydrogen storage in single-walled carbon nanotubes: a combined ab initio and Monte Carlo investigation. The Journal of Chemical Physics. 126: 144704. PMID 17444729 DOI: 10.1063/1.2717170 |
0.587 |
|
| 2007 |
Mpourmpakis G, Froudakis GE, Andriotis AN, Menon M. Enhancement of the Ionization-Potential of K and Rb upon Chemisorption on a C60Molecule The Journal of Physical Chemistry C. 111: 6593-6596. DOI: 10.1021/Jp0711040 |
0.726 |
|
| 2007 |
Mpourmpakis G, Froudakis GE. Why boron nitride nanotubes are preferable to carbon nanotubes for hydrogen storage?An ab initio theoretical study Catalysis Today. 120: 341-345. DOI: 10.1016/J.Cattod.2006.09.023 |
0.589 |
|
| 2006 |
Mpourmpakis G, Tylianakis E, Papanikolaou D, Froudakis GE. A multi scale theoretical study of Li+ interaction with carbon nanotubes. Journal of Nanoscience and Nanotechnology. 6: 3731-5. PMID 17256322 DOI: 10.1166/Jnn.2006.611 |
0.57 |
|
| 2006 |
Mpourmpakis G, Froudakis G. Why alkali metals preferably bind on structural defects of carbon nanotubes: a theoretical study by first principles. The Journal of Chemical Physics. 125: 204707. PMID 17144723 DOI: 10.1063/1.2397679 |
0.616 |
|
| 2006 |
Mpourmpakis G, Froudakis GE, Lithoxoos GP, Samios J. SiC nanotubes: A novel material for hydrogen storage. Nano Letters. 6: 1581-3. PMID 16895338 DOI: 10.1021/Nl0603911 |
0.587 |
|
| 2006 |
Mpourmpakis G, Tylianakis E, Froudakis G. Hydrogen storage in carbon nanotubes: a multi-scale theoretical study. Journal of Nanoscience and Nanotechnology. 6: 87-90. PMID 16573075 DOI: 10.1166/Jnn.2006.17909 |
0.577 |
|
| 2006 |
Mpourmpakis G, Froudakis GE, Tylianakis E. Haeckelites: A promising anode material for lithium batteries application. An ab initio and molecular dynamics theoretical study Applied Physics Letters. 89: 233125. DOI: 10.1063/1.2403922 |
0.595 |
|
| 2005 |
Mpourmpakis G, Froudakis GE, Andriotis AN, Menon M. Role of Co in enhancing the magnetism of small Fe clusters Physical Review B. 72. DOI: 10.1103/Physrevb.72.104417 |
0.694 |
|
| 2005 |
Mpourmpakis G, Froudakis GE, Andriotis AN, Menon M. Carbon-nanotube tips with edge made of a transition metal Applied Physics Letters. 87: 193105. DOI: 10.1063/1.2126116 |
0.729 |
|
| 2004 |
Andriotis AN, Mpourmpakis G, Froudakis GE, Menon M. Magnetic enhancement and magnetic reduction in binary clusters of transition metal atoms. The Journal of Chemical Physics. 120: 11901-4. PMID 15268224 DOI: 10.1063/1.1752878 |
0.718 |
|
| 2004 |
Andriotis AN, Mpourmpakis G, Froudakis GE, Menon M. State-specific RKKY interaction in small magnetic clusters Physical Review B. 70. DOI: 10.1103/Physrevb.70.104421 |
0.706 |
|
| 2003 |
Stratakis M, Rabalakos C, Mpourmpakis G, Froudakis GE. Ene hydroperoxidation of isobutenylarenes within dye-exchanged zeolite Na-Y: control of site selectivity by cation-arene interactions. The Journal of Organic Chemistry. 68: 2839-43. PMID 12662060 DOI: 10.1021/Jo020599G |
0.575 |
|
| 2003 |
Mpourmpakis G, Froudakis GE, Andriotis AN, Menon M. Fe encapsulation by silicon clusters:Ab initioelectronic structure calculations Physical Review B. 68. DOI: 10.1103/Physrevb.68.125407 |
0.695 |
|
| 2003 |
Mpourmpakis G, Froudakis GE, Andriotis AN, Menon M. Understanding the structure of metal encapsulated Si cages and nanotubes: Role of symmetry and d-band filling The Journal of Chemical Physics. 119: 7498-7502. DOI: 10.1063/1.1607309 |
0.72 |
|
| 2002 |
Andriotis AN, Mpourmpakis G, Froudakis GE, Menon M. Stabilization of Si-based cage clusters and nanotubes by encapsulation of transition metal atoms New Journal of Physics. 4: 78-78. DOI: 10.1088/1367-2630/4/1/378 |
0.728 |
|
| 2002 |
Mpourmpakis G, Mühlhäuser M, Froudakis GE, Peyerimhoff SD. Importance of multi-reference configuration interaction for 3Σu−←X3Σg− transitions of linear HC7H Chemical Physics Letters. 356: 398-402. DOI: 10.1016/S0009-2614(02)00390-1 |
0.55 |
|
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