Publications

Author:
Year:

Page: 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 ...20 ....25 ....30 ....35 ....40 ....45 ...49 50 51 52 53 54
"Electronic Stopping Power in Gold: The Role ofdElectrons and theH/HeAnomaly"
M. Ahsan Zeb and J. Kohanoff and D. Sánchez-Portal and A. Arnau and J. I. Juaristi and Emilio Artacho, June 2012
doi:10.1103/physrevlett.108.225504

"Understanding adsorption-induced structural transitions in metal-organic frameworks: From the unit cell to the crystal"
Carles Triguero and François-Xavier Coudert and Anne Boutin and Alain H. Fuchs and Alexander V. Neimark, November 2012
doi:10.1063/1.4765369

"Multielectron effects in high harmonic generation in N2 and benzene: Simulation using a non-adiabatic quantum molecular dynamics approach for laser-molecule interactions"
Daniel Dundas, May 2012
doi:10.1063/1.4718590

"Magnetism of Single Vacancies in Rippled Graphene"
E. J. G. Santos and S. Riikonen and D. Sánchez-Portal and A. Ayuela, March 2012
doi:10.1021/jp300861m

" Universal magnetic properties of sp 3 -type defects in covalently functionalized graphene "
Elton J G Santos and Andrés Ayuela and Daniel Sánchez-Portal, April 2012
doi:10.1088/1367-2630/14/4/043022

"Excess Electron Interactions with Solvated DNA Nucleotides: Strand Breaks Possible at Room Temperature"
Maeve Smyth and Jorge Kohanoff, May 2012
doi:10.1021/ja303776r

"Alkylated organic cages: from porous crystals to neat liquids"
Nicola Giri and Christine E. Davidson and Gavin Melaugh and Mario G. Del Pópolo and James T. A. Jones and Tom Hasell and Andrew I. Cooper and Peter N. Horton and Michael B. Hursthouse and Stuart L. James, April 2012
doi:10.1039/c2sc01007k

"Computational identification of self-inhibitory peptides from envelope proteins"
Yongtao Xu and Noorsaadah A.B.D. Rahman and Rozana Othman and Peijun Hu and Meilan Huang, April 2012
doi:10.1002/prot.24105

"An ignition key for atomic-scale engines"
Daniel Dundas and Brian Cunningham and Claire Buchanan and Asako Terasawa and Anthony T Paxton and Tchavdar N Todorov, September 2012
doi:10.1088/0953-8984/24/40/402203

"Simplifying the representation of complex free-energy landscapes using sketch-map"
Ceriotti,M. and Tribello,G. Parrinello,M., 2011

Page: 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 ...20 ....25 ....30 ....35 ....40 ....45 ...49 50 51 52 53 54