화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Accelerating ab initio molecular dynamics simulations by linear prediction methods
Herr JD, Steele RP
Chemical Physics Letters, 661, 42, 2016
2 Ion-Radical Pair Separation in Larger Oxidized Water Clusters, (H2O)(+)n=6-21
Herr JD, Steele RP
Journal of Physical Chemistry A, 120(36), 7225, 2016
3 Signatures of Size-Dependent Structural Patterns in Hydrated Copper(I) Clusters, Cu+(H2O)(n=1-10)
Herr JD, Steele RP
Journal of Physical Chemistry A, 120(51), 10252, 2016
4 Vibrational Signatures of Electronic Properties in Oxidized Water: Unraveling the Anomalous Spectrum of the Water Dimer Cation
Talbot JJ, Cheng XL, Herr JD, Steele RP
Journal of the American Chemical Society, 138(36), 11936, 2016
5 Structural Progression in Clusters of Ionized Water, (H2O)(n=1-5)(+)
Herr JD, Talbot J, Steele RP
Journal of Physical Chemistry A, 119(4), 752, 2015