Browsing by Author Stampfl, C

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Showing results 1 to 14 of 14
Issue DateTitleAuthor(s)
11-Mar-2014CH <inf>x</inf> adsorption (x = 1-4) and thermodynamic stability on the CeO <inf>2</inf> (111) surface: A first-principles investigationFronzi, M; Piccinin, S; Delley, B; Traversa, E; Stampfl, C
1-Jan-2017Detection of adsorbed transition-metal porphyrins by spin-dependent conductance of graphene nanoribbonKratzer, P; Tawfik, SA; Cui, XY; Stampfl, C
22-Mar-2018Evaluation of van der Waals density functionals for layered materialsTawfik, SA; Gould, T; Stampfl, C; Ford, MJ
28-Sep-2017First-principles investigation of quantum emission from hBN defectsTawfik, SA; Ali, S; Fronzi, M; Kianinia, M; Tran, TT; Stampfl, C; Aharonovich, I; Toth, M; Ford, MJ
8-Sep-2015High On/Off Conductance Switching Ratio via H-Tautomerization in QuinoneTawfik, SA; Cui, XY; Ringer, SP; Stampfl, C
3-Jan-2013Hydrogen adsorption capacity of adatoms on double carbon vacancies of graphene: A trend study from first principlesFair, KM; Cui, XY; Li, L; Shieh, CC; Zheng, RK; Liu, ZW; Delley, B; Ford, MJ; Ringer, SP; Stampfl, C
1-Jan-2018Magnetic properties of stoichiometric and defective Co<inf>9</inf>S<inf>8</inf>Fronzi, M; Tawfik, SA; Stampfl, C; Ford, MJ
1-Jan-2015Multiple CO&lt;inf&gt;2&lt;/inf&gt; capture in stable metal-doped graphene: A theoretical trend studyTawfik, SA; Cui, XY; Ringer, SP; Stampfl, C
18-May-2017Near-Perfect Spin Filtering and Negative Differential Resistance in an Fe(II)S ComplexTawfik, SA; Weston, L; Cui, XY; Ringer, SP; Stampfl, C
14-Mar-2015Sensing sulfur-containing gases using titanium and tin decorated zigzag graphene nanoribbons from first-principlesAbdulkader Tawfik, S; Cui, XY; Carter, DJ; Ringer, SP; Stampfl, C
1-Jan-2018Superconductivity in intercalated buckled two-dimensional materials: KGe <inf>2</inf>Tawfik, SA; Stampfl, C; Ford, MJ
30-Nov-2017TDDFT Study of the Optical Excitation of Nucleic Acid Bases-C <inf>60</inf> ComplexesTawfik, SA; Cui, XY; Ringer, SP; Stampfl, C
-van der Waals forces control the internal chemical structure of monolayers within ABP2X6 lamellar materialsTawfik, SA; Reimers, JR; Stampfl, C; Ford, MJ
4-Oct-2018Van der Waals Forces Control the Internal Chemical Structure of Monolayers within the Lamellar Materials CuInP <inf>2</inf> S <inf>6</inf> and CuBiP <inf>2</inf> Se <inf>6</inf>Tawfik, SA; Reimers, JR; Stampfl, C; Ford, MJ