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3d structure of dendritic and hyper-branched macromolecules by X-ray diffractionPETKOV, Valeri; PARVANOV, Vencislav; TOMALIA, Donald et al.Solid state communications. 2005, Vol 134, Num 10, pp 671-675, issn 0038-1098, 5 p.Article

Variational boundary conditions for molecular dynamics simulations : Treatment of the loading conditionXIANTAO LI.Journal of computational physics (Print). 2008, Vol 227, Num 24, pp 10078-10093, issn 0021-9991, 16 p.Article

Oxygen transport in perovskite and related oxides: A brief reviewCHRONEOS, A; VOVK, R. V; GOULATIS, I. L et al.Journal of alloys and compounds. 2010, Vol 494, Num 1-2, pp 190-195, issn 0925-8388, 6 p.Article

Local stress calculation in simulations of multicomponent systemsBRANICIO, Paulo S; SROLOVITZ, David J.Journal of computational physics (Print). 2009, Vol 228, Num 22, pp 8467-8479, issn 0021-9991, 13 p.Article

Structure of TeO₂·B₂O₃ glasses inferred from infrared spectroscopy and DFT calculationsRADA, S; CULEA, M; CULEA, E et al.Journal of non-crystalline solids. 2008, Vol 354, Num 52-54, pp 5491-5495, issn 0022-3093, 5 p.Article

Bond constraint theory studies of chalcogenide phase change memoriesPAESLER, M. A; BAKER, D. A; LUCOVSKY, G et al.Journal of non-crystalline solids. 2008, Vol 354, Num 19-25, pp 2706-2710, issn 0022-3093, 5 p.Conference Paper

Medium-range order in phospho-silicate bioactive glasses : Insights from MAS-NMR spectra, chemical durability experiments and molecular dynamics simulationsLINATI, Laura; LUSVARDI, Gigliola; MALAVASI, Gianluca et al.Journal of non-crystalline solids. 2008, Vol 354, Num 2-9, pp 84-89, issn 0022-3093, 6 p.Conference Paper

A model for the Ge-O coordination in germanate glassesHANNON, Alex C; DI MARTINO, Daniela; SANTOS, Luis F et al.Journal of non-crystalline solids. 2007, Vol 353, Num 18-21, pp 1688-1694, issn 0022-3093, 7 p.Conference Paper

Phonon dispersion in bulk metallic glass Zr₅₅Cu₃₀Al₁₀Ni₁₅AGARWAL, P. C.Journal of non-crystalline solids. 2006, Vol 352, Num 30-31, pp 3196-3199, issn 0022-3093, 4 p.Article

Heterojunction light emitting diodes fabricated with different n-layer oxide structures on p-GaN layers by magnetron sputteringBO HYUN KONG; WON SUK HAN; YOUNG YI KIM et al.Applied surface science. 2010, Vol 256, Num 16, pp 4972-4976, issn 0169-4332, 5 p.Article

Atomistic simulations of shock waves in cubic silicon carbideCHENG, Q; WU, H. A; WANG, Y et al.Computational materials science. 2009, Vol 45, Num 2, pp 419-422, issn 0927-0256, 4 p.Article

On a geometric model of crystal growth on a flat substrateBREDNIKHINA, Anna; DEBELOV, Victor A.Journal of crystal growth. 2009, Vol 311, Num 3, pp 666-669, issn 0022-0248, 4 p.Conference Paper

Pb-driven anti-ferroelectric phase in Pb(Mg_1/3Nb_2/3)O₃ : First-principle studyRUIZHI ZHANG; CHUNLEI WANG; JICHAO LI et al.Solid state communications. 2008, Vol 145, Num 5-6, pp 299-302, issn 0038-1098, 4 p.Article

Compositional dependence of the first sharp diffraction peaks in alkali silicate glasses : A molecular dynamics studyJINCHENG DU; CORRALES, L. René.Journal of non-crystalline solids. 2006, Vol 352, Num 30-31, pp 3255-3269, issn 0022-3093, 15 p.Article

Molecular dynamics simulation of ternary glasses Li₂S-P₂S₅-LiIPRASADA RAO, R; SESHASAYEE, M.Journal of non-crystalline solids. 2006, Vol 352, Num 30-31, pp 3310-3314, issn 0022-3093, 5 p.Article

On energy models of orientational disorder of molecules in plastic crystalsBAZYLEVA, Ala B; KABO, Gennady J; BLOKHIN, Andrey V et al.Physica. B, Condensed matter. 2006, Vol 383, Num 2, pp 243-252, issn 0921-4526, 10 p.Article

EXAFS study of amorphous Ge₂Sb₂Te₅BAKER, D. A; PAESLER, M. A; LUCOVSKY, G et al.Journal of non-crystalline solids. 2006, Vol 352, Num 9-20, pp 1621-1623, issn 0022-3093, 3 p.Conference Paper

Raman spectrum of single-walled boron nitride nanotubeFAKRACH, B; RAHMANI, A; CHADLI, H et al.Physica. E, low-dimentional systems and nanostructures. 2009, Vol 41, Num 10, pp 1800-1805, issn 1386-9477, 6 p.Article

Formation and behavior of unbonded hydrogen in a-C:H of various compositions and densitiesHOUSKA, J; KLEMBERG-SAPIEHA, J. E; MARTINU, L et al.Surface & coatings technology. 2009, Vol 203, Num 24, pp 3770-3776, issn 0257-8972, 7 p.Article

A molecular dynamics study of the role of the cation in modifying the structure of alkali borate glassesANGEL GONZALEZ, Miguel; MONDELLI, Claudia; D'ANGELO, Giovanna et al.Journal of non-crystalline solids. 2008, Vol 354, Num 2-9, pp 203-207, issn 0022-3093, 5 p.Conference Paper

Elastic buckling analysis of single-walled carbon nanotube under combined loading by using the ANSYS softwareGHORBANPOUR ARANI, A; RAHMANI, R; AREFMANESH, A et al.Physica. E, low-dimentional systems and nanostructures. 2008, Vol 40, Num 7, pp 2390-2395, issn 1386-9477, 6 p.Conference Paper

Simulation of the nanoindentation of hard metal carbide layer systems : the case of nanostructured ultra-hard carbide layer systemsKIZLER, P; SCHMAUDER, S.Computational materials science. 2007, Vol 39, Num 1, pp 205-213, issn 0927-0256, 9 p.Conference Paper