화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Coupled Cluster Studies of Ionization Potentials and Electron Affinities of Single-Walled Carbon Nanotubes
Peng B, Govind N, Apra E, Klemm M, Hammond JR, Kowalski K
Journal of Physical Chemistry A, 121(6), 1328, 2017
2 Theoretical studies of the global minima and polarizabilities of small lithium clusters
Hu HS, Zhao YF, Hammond JR, Bylaska EJ, Apra E, van Dam HJJ, Li J, Govind N, Kowalski K
Chemical Physics Letters, 644, 235, 2016
3 Predicted thermochemistry for chemical conversions of 5-hydroxymethylfurfural
Assary RS, Redfern PC, Hammond JR, Greeley J, Curtiss LA
Chemical Physics Letters, 497(1-3), 123, 2010
4 Computational Studies of the Thermochemistry for Conversion of Glucose to Levulinic Acid
Assary RS, Redfern PC, Hammond JR, Greeley J, Curtiss LA
Journal of Physical Chemistry B, 114(27), 9002, 2010
5 Calculations of molecular properties in hybrid coupled-cluster and molecular mechanics approach
Hammond JR, Valiev M, Dejong WA, Kowalski K
Journal of Physical Chemistry A, 111(25), 5492, 2007