| | Issue Date | Title | Author(s) | Journal |
| 1 | 15-Nov-2021 | Multiphonon diffuse scattering in solids from first principles: Application to layered crystals and two-dimensional materials | Zacharias, Marios ; Seiler, Hélène ; Caruso, Fabio ; Zahn, Daniela ; Giustino, Feliciano ; Kelires, Pantelis C. ; Ernstorfer, Ralph | Physical Review B |
| 2 | 12-Nov-2021 | Efficient First-Principles Methodology for the Calculation of the All-Phonon Inelastic Scattering in Solids | Zacharias, Marios ; Seiler, Hélène ; Caruso, Fabio ; Zahn, Daniela ; Giustino, Feliciano ; Kelires, Pantelis C. ; Ernstorfer, Ralph | Physical Review Letters |
| 3 | 16-Mar-2016 | Composition and stress of SiGe nanostructures on curved substrates | Leontiou, Theodoros ; Kelires, Pantelis C. | Physical Review B |
| 4 | 11-Dec-2013 | Local rigidity and physical trends in embedded Si nanocrystals | Kleovoulou, Konstantinos ; Kelires, Pantelis C. | Physical Review B |
| 5 | 21-Aug-2013 | Stress state of embedded Si nanocrystals | Kleovoulou, Konstantinos ; Kelires, Pantelis C. | Physical Review B |
| 6 | 8-May-2013 | Atomistic simulations of low-density nanoporous materials: Carbon nanofoams | Mathioudakis, Christos ; Kelires, Pantelis C. | Physical Review B |
| 7 | 27-Apr-2012 | Ordering Mechanisms in Epitaxial Sige Nanoislands | Kelires, Pantelis C. ; Vantarakis, George ; Remediakis, Ioannis N. | Physical Review Letters |
| 8 | 3-Dec-2010 | Suppression of intermixing in strain-relaxed epitaxial layers | Leontiou, Theodoros ; Tersoff, Jerry ; Kelires, Pantelis C. | Physical Review Letters |
| 9 | 9-Sep-2010 | Optical gaps of free and embedded si nanoclusters: density functional theory calculations | Hadjisavvas, George C. ; Idrobo, Juan Carlos ; Kelires, Pantelis C. | Physical Review B |
| 10 | 15-Jul-2009 | Interfacial disorder and optoelectronic properties of diamond nanocrystals | Vantarakis, George ; Kopidakis, Georgios ; Wang, Caizhuang ; Ho, Kaiming ; Kelires, Pantelis C. ; Mathioudakis, Christos | Physical Review B |
| 11 | 2008 | Self-assembly and ordering mechanisms of Ge islands on prepatterned Si(001) | Pascale, Alina ; Berbezier, Isabelle ; Ronda, Antoine ; Kelires, Pantelis C. | Physical Review B |
| 12 | 21-Jul-2006 | Shape and faceting of si nanocrystals embedded in a-si o2: A Monte Carlo study | Hadjisavvas, George C. ; Remediakis, Ioannis N. ; Kelires, Pantelis C. | Physical Review B |
| 13 | 9-Jun-2006 | Probing the structure and energetics of dislocation cores in sige alloys through Monte Carlo simulations | Remediakis, Ioannis N. ; Jesson, David E. ; Kelires, Pantelis C. | Physical review letters |
| 14 | 19-May-2005 | Critical aspects of alloying and stress relaxation in ge/si(100) islands | Hadjisavvas, George C. ; Kelires, Pantelis C. | Physical Review B |
| 15 | 2-Dec-2004 | Influence of germanium ad-dimers on carbon incorporation in the si(001) surface | Sonnet, Ph ; Stauffer, Louise ; Kelires, Pantelis C. | Physical Review B |
| 16 | 2-Sep-2004 | Physical trends in amorphous carbon: a tight-binding molecular-dynamics study | Kopidakis, Georgios ; Kelires, Pantelis C. ; Mathioudakis, Christos | Physical Review B |
| 17 | 23-Mar-2004 | Computational investigation of intrinsic localization in crystalline Si | Voulgarakis, Nikolaos K. ; Hadjisavvas, George C. ; Kelires, Pantelis C. | Physical Review B |
| 18 | 9-Jun-2003 | Stress and composition of c-induced ge dots on si(100) | Hadjisavvas, George C. ; Sonnet, Philippe ; Kelires, Pantelis C. | Physical Review B |
| 19 | 2003 | Energetics and stability of nanostructured amorphous carbon | Fyta, Maria G. ; Remediakis, Ioannis N. ; Kelires, Pantelis C. | Physical Review B |
| 20 | 13-Nov-2002 | Theory of bond-length variations in relaxed, strained, and amorphous silicon-germanium alloys | Tzoumanekas, Christos ; Kelires, Pantelis C. | Physical Review B |