2018
Recent developments and applications of the real-space multigrid method

J Bernholc , Miroslav Hodak , Wenchang Lu
Journal of Physics: Condensed Matter 20 ( 29) 294205

24
2008
Theoretical bounds for multiwalled carbon nanotube growth

M Buongiorno Nardelli , C Roland , J Bernholc
Chemical Physics Letters 296 ( 5) 471 -476

14
1998
Oxidation- and organic-molecule-induced changes of the Si surface optical anisotropy: ab initio predictions

W G Schmidt , F Fuchs , A Hermann , K Seino
Journal of Physics: Condensed Matter 16 ( 39)

13
2004
Theory of Interfaces and Surfaces of Wide-Gap Nitrides

Krzysztof Rapcewicz , Marco Buongiorno Nardelli , Claudia Bungaro , E. L. Briggs
MRS Proceedings 482 ( 1) 899

2
1997
Atomic indium nanowires on Si(1 1 1): the (4 × 1)–(8 × 2) phase transition studied with reflectance anisotropy spectroscopy

K Fleischer , S Chandola , N Esser , W Richter
Applied Surface Science 234 ( 1) 302 -306

15
2004
Mechanical properties, defects and electronic behavior of carbon nanotubes

M Buongiorno Nardelli , J.-L Fattebert , D Orlikowski , C Roland
Carbon 38 ( 1112) 1703 -1711

252
2000
Relaxor ferroelectric polymer exhibits ultrahigh electromechanical coupling at low electric field

Xin Chen , Hancheng Qin , Xiaoshi Qian , Wenyi Zhu
Science 375 ( 6587) 1418 -1422

29
2022
Morphology-induced dielectric enhancement in polymer nanocomposites

Bing Zhang , Xin Chen , Wenchang Lu , QM Zhang
Nanoscale 13 ( 24) 10933 -10942

18
2021
Ab initio simulations of metal contacts for graphene-based devices

Hancheng Qin , Wenchang Lu , J Bernholc
Journal of Applied Physics 131 ( 21)

2
2022
IV. Flourine-based Mechanisms for ALE Growth on Diamond (110)

MG Wensell , Z Zhang , J Bernholc
Semiannual Technical Report 35

1995
Computational Study of Supramolecular Self-Assembly Using CH/π Bonds

C Han , Q Li , S Horton , M Fuentes-Cabrera
APS March Meeting Abstracts 2012 A6. 005 -A6. 005

2012
Giant electrostriction enabled by defect-induced critical phenomena in relaxor ferroelectric polymers

Xin Chen , Hancheng Qin , Wenyi Zhu , Bing Zhang
Macromolecules 56 ( 2) 690 -696

9
2023
Interfacial origin of dielectric constant enhancement in high-temperature polymer dilute nanocomposites

Xin Chen , Hancheng Qin , Yang Liu , Yen-Ting Lin
Applied Physics Letters 122 ( 21)

5
2023
Clusters and Cluster-Assembled Materials

RE Haufler , Y Chai , LPF Chibante , J Conceicao
MRS Proc. 206 627 -631

17
1991
Electro-thermal actuation in percolative ferroelectric polymer nanocomposites

Yang Liu , Yao Zhou , Hancheng Qin , Tiannan Yang
Nature Materials 22 ( 7) 873 -879

12
2023
Microstructures and ferroelectric properties of poly (vinylidene fluoride-ter-trifluoroethylene-ter-vinyl fluoride) terpolymers

Zhubing Han , Hancheng Qin , Xin Chen , Wenhan Xu
Macromolecules 56 ( 11) 4065 -4074

3
2023
Properties of High-Performance Capacitor Materials and Nanoscale Electronic Devices

J Bernholc , V Ranjan , XH Zheng , J Jiang
2010 DoD High Performance Computing Modernization Program Users Group Conference 195 -200

2
2010
Electronic Properties of High-Performance Capacitor Materials and Nanoscale Multiterminal Devices

J Bernholc , L Yu , V Ranjan , M Buongiorno Nardelli
2009 DoD High Performance Computing Modernization Program Users Group Conference 313 -320

2009