Coarse grain modeling of polyimide copolymersCHAKRABARTY, Arnab; CAGIN, Tahir.Polymer (Guildford). 2010, Vol 51, Num 12, pp 2786-2794, issn 0032-3861, 9 p.Article

Fundamental studies on stress-corrosion cracking in iron and underlying mechanismsPHAM, Hieu H; CAGIN, Tahir.Acta materialia. 2010, Vol 58, Num 15, pp 5142-5149, issn 1359-6454, 8 p.Article

Thermo-mechanical properties of a piezoelectric polyimide carbon nanotube composite: Assessment of composite theoriesCHAKRABARTY, Arnab; CAGIN, Tahir.Computational materials science. 2014, Vol 92, pp 185-191, issn 0927-0256, 7 p.Article

MPiSIM: Massively parallel simulation tool for metallic systemYUE QI; CAGIN, Tahir; GODDARD, William A et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 185-192, issn 0928-1045Conference Paper

Crack propagation in a Tantalum nano-slabSTRACHAN, Alejandro; CAGIN, Tahir; GODDARD, William A et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 151-159, issn 0928-1045Conference Paper

Third annual Caltech ASCI/ASAP Center Material Properties Workshop, Urbana, IL, USA, January 24-25, 2001: The fundamental approaches to dynamic response of materialsCAGIN, Tahir; GODDARD, William A.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, issn 0928-1045, 172 p.Conference Proceedings

Phonon Engineering in Carbon Nanotubes by Controlling Defect ConcentrationSEVIK, Cem; SEVINCLI, Haldun; CUNIBERTI, Gianaurelio et al.Nano letters (Print). 2011, Vol 11, Num 11, pp 4971-4977, issn 1530-6984, 7 p.Article

Viscous heating in nanoscale shear driven liquid flowsBO HUNG KIM; BESKOK, Ali; CAGIN, Tahir et al.Microfluidics and nanofluidics (Print). 2010, Vol 9, Num 1, pp 31-40, issn 1613-4982, 10 p.Article

Sugar, water and free volume networks in concentrated sucrose solutionsMOLINERO, Valeria; CAGIN, Tahir; GODDARD, William A et al.Chemical physics letters. 2003, Vol 377, Num 3-4, pp 469-474, issn 0009-2614, 6 p.Article

Molecular dynamics simulations to compute the bulk response of amorphous PMMASANE, Sandeep B; CAGIN, Tahir; KNAUSS, Wolfgang G et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 87-106, issn 0928-1045Conference Paper

Application of lightweight threading techniques to computational chemistryTHORNLEY, John; MULLER, Richard P; MAINZ, Daniel T et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 173-184, issn 0928-1045Conference Paper

Viscosities of liquid metal alloys from nonequilibrium molecular dynamicsQI, Yue; CAGIN, Tahir; KIMURA, Yoshitaka et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 233-243, issn 0928-1045Conference Paper

Kinks in the a/2<111> screw dislocation in TaGUOFENG WANG; STRACHAN, Alejandro; CAGIN, Tahir et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 117-125, issn 0928-1045Conference Paper

Ab-initio studies of pressure induced phase transitions in BaOULUDOGAN, Mustafa; CAGIN, Tahir; STRACHAN, Alejandro et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 193-202, issn 0928-1045Conference Paper

On the limitations of the DFT+U approach to energetics of actinidesBAJAJ, Saurabh; SEVIK, Cem; CAGIN, Tahir et al.Computational materials science. 2012, Vol 59, pp 48-56, issn 0927-0256, 9 p.Article

Atomic simulations of kinetic friction and its velocity dependence at Al/Al and α-Al₂O₃/α-Al₂O₃ interfacesQING ZHANG; YUE QI; HECTOR, Louis G et al.Physical review B. Condensed matter and materials physics. 2005, Vol 72, Num 4, pp 045406.1-045406.12, issn 1098-0121Article

Effect of solvent and pH on the structure of PAMAM dendrimersMAITI, Prabal K; CAGIN, Tahir; LIN, Shiang-Tai et al.Macromolecules. 2005, Vol 38, Num 3, pp 979-991, issn 0024-9297, 13 p.Article

An artificial-viscosity method for the lagrangian analysis of shocks in solids with strength on unstructured, arbitrary-order tetrahedral meshesLEW, A; RADOVITZKY, R; ORTIZ, M et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 213-231, issn 0928-1045Conference Paper

A multiscale approach for modeling crystalline solidsCUITNO, Alberto M; STAINIER, Laurent; GUOFENG WANG et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 127-149, issn 0928-1045Conference Paper

Cluster-ion bombardment studies to reveal the amorphization mode in strained Si_0.8Ge_0.2MARTIN, Michael S; DI CHEN; THOMPSON, Phillip E et al.Philosophical magazine letters. 2012, Vol 92, Num 10-12, pp 625-632, issn 0950-0839, 8 p.Article

Accurate calculations of the Peierls stress in small periodic cellsSEGALL, D. E; ARIAS, T. A; STRACHAN, A et al.Journal of computer-aided materials design. 2001, Vol 8, Num 2-3, pp 161-172, issn 0928-1045Conference Paper

Molecular dynamics study of the binary Cu₄₆Zr₅₄ metallic glass motivated by experiments : Glass formation and atomic-level structureGANG DUAN; DONGHUA XU; QING ZHANG et al.Physical review B. Condensed matter and materials physics. 2005, Vol 71, Num 22, pp 224208.1-224208.9, issn 1098-0121Article