22
TITLE: Fragment molecular orbital investigation of the role of AMP protonation in firefly luciferase pH-sensitivity  Full Text
AUTHORS: Bruce F Milne; Miguel A L Marques; Fernando Nogueira ;
PUBLISHED: 2010, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 12, ISSUE: 42
INDEXED IN: Scopus WOS CrossRef: 40
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25
TITLE: Density-matrix-power functional: Performance for finite systems and the homogeneous electron gas
AUTHORS: Lathiotakis, NN; Sharma, S; Dewhurst, JK; Eich, FG; Marques, MAL; Gross, EKU;
PUBLISHED: 2009, SOURCE: PHYSICAL REVIEW A, VOLUME: 79, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef
26
TITLE: Optical and magnetic properties of boron fullerenes  Full Text
AUTHORS: Silvana Botti; Alberto Castro; Nektarios N Lathiotakis; Xavier Andrade; Miguel A L Marques;
PUBLISHED: 2009, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 11, ISSUE: 22
INDEXED IN: Scopus WOS CrossRef
27
TITLE: The role of dimensionality on the quenching of spin-orbit effects in the optics of gold nanostructures  Full Text
AUTHORS: Alberto Castro; Miguel A L Marques; Aldo H Romero; Micael J T Oliveira; Angel Rubio;
PUBLISHED: 2008, SOURCE: JOURNAL OF CHEMICAL PHYSICS, VOLUME: 129, ISSUE: 14
INDEXED IN: Scopus WOS CrossRef
28
TITLE: Specification of an extensible and portable file format for electronic structure and crystallographic data  Full Text
AUTHORS: Gonze, X; O Almbladh; Cucca, A; Caliste, D; Freysoldt, C; Marques, MAL; Olevano, V; Pouillon, Y; Verstraete, MJ;
PUBLISHED: 2008, SOURCE: COMPUTATIONAL MATERIALS SCIENCE, VOLUME: 43, ISSUE: 4
INDEXED IN: Scopus WOS CrossRef
29
TITLE: On the Use of Neumann's Principle for the Calculation of the Polarizability Tensor of Nanostructures
AUTHORS: Micael J T Oliveira; Alberto Castro; Miguel A L Marques; Angel Rubio;
PUBLISHED: 2008, SOURCE: JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY, VOLUME: 8, ISSUE: 7
INDEXED IN: Scopus WOS CrossRef
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