검색결과 : 6건
| No. | Article |
|---|---|
| 1 |
A framework for optimizing oxygen vacancy formation in doped perovskites Hanselman CL, Tafen D, Alfonso DR, Lekse JW, Matranga C, Miller DC, Gounaris CE Computers & Chemical Engineering, 126, 168, 2019 |
| 2 |
Kinetic Monte Carlo Simulation of CO Adsorption on Sulfur-Covered Pd(100) Alfonso DR Journal of Physical Chemistry A, 118(35), 7306, 2014 |
| 3 |
Adsorption and decomposition of H2S on Pd(111) surface: a first-principles study Alfonso DR, Cugini AV, Sorescu DC Catalysis Today, 99(3-4), 315, 2005 |
| 4 |
Characterization of water clusters in organic molecular hosts from density functional theory calculations Alfonso DR, Karapetian K, Sorescu DC, Jordan KD Journal of Physical Chemistry B, 108(11), 3431, 2004 |
| 5 |
Rearrangement pathways of the water trimer and tetramer anions Alfonso DR, Jordan KD Journal of Chemical Physics, 116(9), 3612, 2002 |
| 6 |
Periodic density functional LDA and GGA study of CO adsorption at the (001) surface of MgO Snyder JA, Alfonso DR, Jaffe JE, Lin ZJ, Hess AC, Gutowski M Journal of Physical Chemistry B, 104(19), 4717, 2000 |