Year |
Citation |
Score |
2017 |
Sohlberg K, Bazargan G, Angelo JP, Lee C. Application of semiempirical electronic structure theory to compute the force generated by a single surface-mounted switchable rotaxane. Journal of Molecular Modeling. 23: 29. PMID 28084553 DOI: 10.1007/S00894-016-3201-Z |
0.331 |
|
2016 |
Li J, Zhu C, Qiao Z, Chen X, Wei W, Ji H, Sohlberg K. A first principles study of interactions of CO2 with surfaces of a Cu(benzene-1,3,5-tricarboxylate) metal organic framework Applied Surface Science. 385: 578-586. DOI: 10.1016/J.Apsusc.2016.05.118 |
0.3 |
|
2015 |
Sohlberg K, Pennycook TJ, Zhou W, Pennycook SJ. Insights into the physical chemistry of materials from advances in HAADF-STEM. Physical Chemistry Chemical Physics : Pccp. 17: 3982-4006. PMID 25586364 DOI: 10.1039/C4Cp04232H |
0.578 |
|
2015 |
Liu X, Sohlberg K. The influence of oxygen vacancies and La doping on the surface structure of NaTaO3 Computational Materials Science. 103: 1-7. DOI: 10.1016/J.Commatsci.2015.03.004 |
0.302 |
|
2014 |
Wexler RB, Sohlberg K. Role of proton hopping in surface charge transport on tin dioxide as revealed by the thermal dependence of conductance. The Journal of Physical Chemistry. A. 118: 12031-40. PMID 25275726 DOI: 10.1021/Jp5076719 |
0.321 |
|
2012 |
Foster ME, Sohlberg K. Self-consistent addition of an atomic charge dependent hydrogen-bonding correction function Computational and Theoretical Chemistry. 984: 9-12. DOI: 10.1016/J.Comptc.2011.12.027 |
0.315 |
|
2011 |
Foster ME, Sohlberg K. Computational investigation of the role of counterions and reorganization energy in a switchable bistable [2]rotaxane. The Journal of Physical Chemistry. A. 115: 7773-7. PMID 21595443 DOI: 10.1021/Jp202163J |
0.319 |
|
2011 |
Lee C, Maeng G, Kim H, Sohlberg K. Quantum mechanical modeling of a tripodal [2]rotaxane and its binding to TiO2 Computational and Theoretical Chemistry. 966: 180-185. DOI: 10.1016/J.Comptc.2011.02.032 |
0.322 |
|
2010 |
Cai S, Caldararu M, Sohlberg K. Entropic Contributions to the Atomic-Scale Charge-Carrier/Surface Interactions That Govern Macroscopic Surface Conductance Journal of Physical Chemistry C. 114: 3991-3997. DOI: 10.1021/Jp910169N |
0.331 |
|
2010 |
Lee C, Sohlberg K. The effect of substitution on reorganization energy and charge mobility in metal free phthalocyanine Chemical Physics. 367: 7-19. DOI: 10.1016/J.Chemphys.2009.10.005 |
0.316 |
|
2009 |
Rossi M, Sohlberg K. Predictions of Hole Mobility in Molecular Organic Crystals : Incorporating Thermal Effects Journal of Physical Chemistry C. 113: 6821-6831. DOI: 10.1021/Jp8086978 |
0.326 |
|
2008 |
Sohlberg K, Zhuo S, Nellist P, Peng Y, Pennycook S. Evidence of High-Pressure Rhodium Sesquioxide in the Rhodium/γ-Alumina Catalytic System The Journal of Physical Chemistry C. 112: 11831-11834. DOI: 10.1021/Jp801089J |
0.315 |
|
2007 |
Rashkeev SN, Sohlberg KW, Zhuo S, Pantelides ST. Hydrogen-Induced Initiation of Corrosion in Aluminum Journal of Physical Chemistry C. 111: 7175-7178. DOI: 10.1021/Jp0707687 |
0.443 |
|
2007 |
Cai S, Caldararu M, Chihaia V, Munteanu C, Hornoiu C, Sohlberg K. Possible dual-charge-carrier mechanism of surface conduction on gamma-alumina Journal of Physical Chemistry C. 111: 5506-5513. DOI: 10.1021/Jp068817N |
0.323 |
|
2007 |
Borisevich A, Sohlberg K, Caldararu M, Pantelides S, Pennycook S. Structure-Properties Relationships in SnO2/Al2O3 and Pt/SnO2/Al2O3 Catalysts Microscopy and Microanalysis. 13: 570-571. DOI: 10.1017/S143192760707746X |
0.409 |
|
2007 |
Cai S, Chihaia V, Sohlberg K. Interactions of methane, ethane and pentane with the (110C) surface of γ-alumina Journal of Molecular Catalysis a-Chemical. 275: 63-71. DOI: 10.1016/J.Molcata.2007.05.025 |
0.323 |
|
2006 |
Dobbs KD, Sohlberg K. 2-Phenylpyridine: To Twist or Not To Twist? Journal of Chemical Theory and Computation. 2: 1530-1537. PMID 26627023 DOI: 10.1021/Ct600242M |
0.317 |
|
2006 |
Cai S, Sohlberg K. Adsorption of 1-hexene on γ-alumina (110C) Journal of Molecular Catalysis a: Chemical. 248: 76-83. DOI: 10.1016/J.Molcata.2005.11.059 |
0.308 |
|
2004 |
Sohlberg K, Rashkeev S, Borisevich AY, Pennycook SJ, Pantelides ST. Origin of anomalous Pt-Pt distances in the Pt/alumina catalytic system. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 5: 1893-7. PMID 15648138 DOI: 10.1002/Cphc.200400212 |
0.46 |
|
2004 |
Wang S, Borisevich AY, Rashkeev SN, Glazoff MV, Sohlberg K, Pennycook SJ, Pantelides ST. Dopants adsorbed as single atoms prevent degradation of catalysts. Nature Materials. 3: 143-6. PMID 14991014 DOI: 10.1038/Nmat1077 |
0.491 |
|
2004 |
Zheng X, Sohlberg K. Modeling bistability and switching in a [2]catenane Physical Chemistry Chemical Physics. 6: 809-815. DOI: 10.1039/B310816C |
0.32 |
|
2004 |
Borisevich AY, Wang S, Rashkeev SN, Pantelides ST, Sohlberg K, Pennycook SJ. Single-atom sensitivity for solving catalysis problems Microscopy and Microanalysis. 10: 460-461. DOI: 10.1017/S1431927604886392 |
0.409 |
|
2003 |
Cai S, Rashkeev SN, Pantelides ST, Sohlberg K. Phase transformation mechanism between γ- and θ-alumina Physical Review B. 67. DOI: 10.1103/Physrevb.67.224104 |
0.473 |
|
2003 |
Rashkeev SN, Sohlberg K, Glazoff MV, Novak J, Pennycook SJ, Pantelides ST. Transition metal atoms on different alumina phases: The role of subsurface sites on catalytic activity Physical Review B. 67. DOI: 10.1103/Physrevb.67.115414 |
0.46 |
|
2003 |
Zheng X, Sohlberg K. Modeling of a Rotaxane-Based Molecular Device Journal of Physical Chemistry A. 107: 1207-1215. DOI: 10.1021/Jp0267611 |
0.315 |
|
2002 |
Cai SH, Rashkeev SN, Pantelides ST, Sohlberg K. Atomic scale mechanism of the transformation of gamma-alumina to theta-alumina. Physical Review Letters. 89: 235501. PMID 12485016 DOI: 10.1103/Physrevlett.89.235501 |
0.448 |
|
2002 |
Rashkeev SN, Sohlberg K, Glazoff MV, Novak J, Pennycook SJ, Pantelides ST. Chromium and Lanthanum on Transition Alumina Surfaces: The Role of Bulk Point-Defect Distributions on Catalytic Activity Mrs Proceedings. 751. DOI: 10.1557/Proc-751-Z2.7 |
0.488 |
|
2002 |
Zheng X, Sohlberg K. Modeling of a Rotaxane-based Molecular Device Mrs Proceedings. 741. DOI: 10.1557/Proc-741-J6.4 |
0.32 |
|
2002 |
Cai S, Sohlberg K. Migration of Aluminum Atoms in the Transformation of γ–to θ–Alumina Mrs Proceedings. 731. DOI: 10.1557/Proc-731-W3.6 |
0.324 |
|
2001 |
Sohlberg K, Pantelides ST, Pennycook SJ. Interactions of hydrogen with CeO2 Journal of the American Chemical Society. 123: 6609-6611. PMID 11439047 DOI: 10.1021/Ja004008K |
0.455 |
|
2001 |
Kim M, Duscher G, Browning ND, Sohlberg K, Pantelides ST, Pennycook SJ. Nonstoichiometry and the electrical activity of grain boundaries in SrTiO3. Physical Review Letters. 86: 4056-9. PMID 11328094 DOI: 10.1103/Physrevlett.86.4056 |
0.46 |
|
2001 |
Sohlberg K, Pantelides ST, Pennycook SJ. Surface reconstruction and the difference in surface acidity between γ- and η-alumina Journal of the American Chemical Society. 123: 26-29. PMID 11273597 DOI: 10.1021/Ja002095A |
0.442 |
|
2000 |
Pennycook SJ, Kim M, Duscher G, Browning ND, Sohlberg K, Pantelides ST. The Origin of Electrical Activity at Grain Boundaries in Perovskites and Related Materials Mrs Proceedings. 654. DOI: 10.1557/Proc-654-Aa1.3.1 |
0.465 |
|
2000 |
Sohlberg K, Pantelides ST, Pennycook SJ. Theoretical explanation of Pt trimers observed by Z-contrast STEM Materials Research Society Symposium - Proceedings. 589: 241-246. DOI: 10.1557/Proc-589-241 |
0.476 |
|
2000 |
Sohlberg K, Pennycook SJ, Pantelides ST. The bulk and surface structure of γ-Alumina Chemical Engineering Communications. 181: 107-135. DOI: 10.1080/00986440008912818 |
0.462 |
|
2000 |
Kim M, Duscher G, Browning ND, Pennycook SJ, Sohlberg K, Pantelides ST. The Role of Non-Stoichiometry in the Electrical Activity of Grain Boundaries in SrTiO3 Microscopy and Microanalysis. 6: 184-185. DOI: 10.1017/S1431927600033419 |
0.395 |
|
2000 |
Sohlberg K, Pantelides ST, Pennycook SJ. Theoretical proposal: A tunable heterogeneous catalyst Surface Science. 470. DOI: 10.1016/S0039-6028(00)00915-8 |
0.471 |
|
1999 |
Kim M, Browning ND, Pennyscook SJ, Sohlberg K, Pantelides ST. Z-Contrast STEM Imaging and Ab-Initio Calculations of Grain Boundaries in SrTiO Mrs Proceedings. 586: 37. DOI: 10.1557/Proc-586-37 |
0.459 |
|
1999 |
Sohlberg K, Pennycook SJ, Pantelides ST. The role of hydrogen in the structure of γ-alumina Materials Research Society Symposium - Proceedings. 549: 165-170. DOI: 10.1557/Proc-549-165 |
0.453 |
|
1999 |
Sohlberg K, Pennycook SJ, Pantelides ST. Explanation of the observed dearth of three-coordinated Al on γ-alumina surfaces Journal of the American Chemical Society. 121: 10999-11001. DOI: 10.1021/Ja9926358 |
0.481 |
|
1999 |
Sohlberg K, Pennycook SJ, Pantelides ST. Hydrogen and the structure of the transition aluminas Journal of the American Chemical Society. 121: 7493-7499. DOI: 10.1021/Ja991098O |
0.482 |
|
1999 |
Sohlberg K, Sumpter BG, Noid DW. Semi-empirical study of a prototype rotaxane-based molecular shuttle Journal of Molecular Structure-Theochem. 491: 281-286. DOI: 10.1016/S0166-1280(99)00190-6 |
0.312 |
|
1997 |
Sohlberg K, Yarkony DR. New and unusual bonding in open shell Van Der Waals molecules revealed by the heavy atom effect: The case of BAr Journal of Physical Chemistry A. 101: 3166-3173. DOI: 10.1021/Jp963845Z |
0.319 |
|
1996 |
Sohlberg K, Szalewicz K. Dynamical coupling of the diatom vibrational motions in collisions of N2 with N+2 Chemical Physics. 206: 87-101. |
0.456 |
|
1991 |
Sohlberg K, Futrell J, Szalewicz K. The role of symmetry in collisions of N2 with N+2 Journal of Chemical Physics. 94: 6500-6507. DOI: 10.1063/1.460278 |
0.52 |
|
1991 |
Sohlberg K, Futrell J, Szalewicz K. The role of symmetry in collisions of N2 with N2 + The Journal of Chemical Physics. 94: 6500-6507. |
0.409 |
|
1990 |
Sohlberg K, Szalewicz K. Fusion rates for deuterium in titanium clusters Physics Letters A. 144: 365-370. DOI: 10.1016/0375-9601(90)90142-B |
0.537 |
|
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