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Results 1 to 25 of 687

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Molecular dynamic study for nanopatterning using atomic force microscopyKIM, Young-Suk; NA, Kyoung-Hoan; KIM, Chan-Il et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2005, Vol 36, Num 1, pp 169-176, issn 1073-5623, 8 p.Article

Statistical errors in molecular dynamics averages = Erreurs statistiques dans les moyennes de dynamique moléculaireSCHIFERL, S. K; WALLACE, D. C.The Journal of chemical physics. 1985, Vol 83, Num 10, pp 5203-5209, issn 0021-9606Article

Investigating Damage Evolution at the Nanoscale: Molecular Dynamics Simulations of Nanovoid Growth in Single-Crystal AluminumBHATIA, M. A; SOLANKI, K. N; MOITRA, A et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2013, Vol 44, Num 2, pp 617-626, issn 1073-5623, 10 p.Conference Paper

A Molecular Dynamics Simulation Study of the Cavitation Pressure in Liquid AlHOYT, Jeffrey J; POTTER, Alice A.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2012, Vol 43, Num 11, pp 3972-3977, issn 1073-5623, 6 p.Conference Paper

Molecular-dynamics study of mechanical deformation in nano-crystalline aluminumKADAU, K; GERMANN, T. C; LOMDAHL, P. S et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2004, Vol 35, Num 9, pp 2719-2723, issn 1073-5623, 5 p.Conference Paper

Ab Initio Molecular Dynamics Simulation of the Amorphous Structure of Ca-Mg-Cu and Ca-Mg-Zn AlloysSENKOV, O. N; CHENG, Y. Q.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2013, Vol 44, Num 5, pp 1980-1989, issn 1073-5623, 10 p.Conference Paper

Molecular dynamics simulations of reconstructed NiO surfacesFISHER, Craig A. J.Scripta materialia. 2004, Vol 50, Num 7, pp 1045-1049, issn 1359-6462, 5 p.Article

Influence of Nanotwin Boundary on the Bauschinger's Effect in Cu: A Molecular Dynamics Simulation StudyZHU, D; ZHANG, H; LI, D. Y et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2013, Vol 44, Num 9, pp 4207-4217, issn 1073-5623, 11 p.Article

Mechanical response of nanoporous goldFARKAS, Diana; CARO, Alfredo; BRINGA, Eduardo et al.Acta materialia. 2013, Vol 61, Num 9, pp 3249-3256, issn 1359-6454, 8 p.Article

Dissolutive wetting of Ag on Cu : A molecular dynamics simulation studyWEBB, Edmund B; GREST, Gary S; HEINE, David R et al.Acta materialia. 2005, Vol 53, Num 11, pp 3163-3177, issn 1359-6454, 15 p.Article

Dynamic characteristics of nanoindentation using atomistic simulationFANG, Te-Hua; CHANG, Wen-Yang; HUANG, Jian-Jin et al.Acta materialia. 2009, Vol 57, Num 11, pp 3341-3348, issn 1359-6454, 8 p.Article

Electrochemical, quantum chemical, and molecular dynamics studies on the interaction of 4-amino-4H,3,5-di(methoxy)-1,2,4-triazole (ATD), BATD, and DBATD on copper metal in 1N H2SO4JOHN, S; JOY, J; PRAJILA, M et al.Materials and corrosion (1995). 2011, Vol 62, Num 11, pp 1031-1041, issn 0947-5117, 11 p.Article

Capillary-driven grain boundary motion and grain rotation in a tricrystal: A molecular dynamics studyTRAUTT, Z. T; MISHIN, Y.Acta materialia. 2014, Vol 65, pp 19-31, issn 1359-6454, 13 p.Article

Molecular Dynamics Simulations of Dislocation Activity in Single-Crystal and Nanocrystalline Copper Doped with AntimonyRAJGARHIA, Rahul K; SPEAROT, Douglas E; SAXENA, Ashok et al.Metallurgical and materials transactions. A, Physical metallurgy and materials science. 2010, Vol 41, Num 4, pp 854-860, issn 1073-5623, 7 p.Conference Paper

Molecular dynamics study of the hcp-bcc phase transformation in nanocrystalline zirconiumSHIFANG XIAO; MINGZHI WEI; WANGYU HU et al.International journal of materials research. 2008, Vol 99, Num 6, pp 626-631, issn 1862-5282, 6 p.Conference Paper

A simulation model for hydrogen in palladium. II. Mobility and thermotransport = Un modèle de simulation pour l'hydrogène dans le palladium. II: Mobilité et thermotransportGILLAN, M. J.Journal of physics. C. Solid state physics. 1987, Vol 20, Num 4, pp 521-538, issn 0022-3719Article

Grain-boundary melting transition in an atomistic simulation model = Transition de fusion de joint de grains dans un modèle de simulation atomistiqueTUE NGUYEN; HO, P. S; KWOK, T et al.Physical review letters. 1986, Vol 57, Num 15, pp 1919-1922, issn 0031-9007Article

Calculation of defect migration energies using molecular dynamics = Calcul des énergies de migration de défaut par dynamique moléculaireMATTHAI, C. C.Philosophical magazine. A. Physics of condensed matter. Defects and mechanical properties. 1985, Vol 52, Num 3, pp 305-308, issn 0141-8610Article

Computer simulations of the dynamical properties of the metallic superlattices, Au/Ni = Simulations sur ordinateur des propriétés dynamiques des superréseaux métalliques Au/NiSASAJIMA, Y; IMAFUKU, M; YAMAMOTO, R et al.Journal of physics. F. Metal physics. 1984, Vol 14, Num 9, pp L167-L172, issn 0305-4608Article

Atomistic simulation and virtual diffraction characterization of stable and metastable alumina surfacesCOLEMAN, Shawn P; SPEAROT, Douglas E.Acta materialia. 2014, Vol 78, pp 354-368, issn 1359-6454, 15 p.Article

Effect of solute atoms on glass-forming ability for Fe-Y-B alloy: An ab initio molecular dynamics studyHAN, J. J; WANG, W. Y; LIU, X. J et al.Acta materialia. 2014, Vol 77, pp 96-110, issn 1359-6454, 15 p.Article

The Estimation of Structural Properties for Molten CaO-CaF2-SiO2 System by Molecular Dynamics SimulationsASADA, Tsuyoshi; YAMADA, Yoshiki; ITO, Kimihisa et al.ISIJ international. 2008, Vol 48, Num 1, pp 120-122, issn 0915-1559, 3 p.Article

Stress evolution due to medium-energy ion bombardment of siliconKALYANASUNDARAM, N; MOORE, M. C; FREUND, J. B et al.Acta materialia. 2006, Vol 54, Num 2, pp 483-491, issn 1359-6454, 9 p.Article

Disordering and melting of aluminum surfaces = Désordre et fusion de surfaces d'aluminiumSTOLTZE, P; NORSKOV, J. K; LANDMAN, U et al.Physical review letters. 1988, Vol 61, Num 4, pp 440-443, issn 0031-9007Article

Effect of alkyl chain length on inhibition performance of imidazoline derivatives investigated by molecular dynamics simulationYU, L. J; ZHANG, J; QIAO, G. M et al.Materials and corrosion (1995). 2013, Vol 64, Num 3, pp 225-230, issn 0947-5117, 6 p.Article

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