High-throughput Discovery, Development, and Demonstration of Material Systems to Enable Low-power NEMS-based Computation

Project Personnel

Robert Carpick

Principal Investigator

University of Pennsylvania

Email

Maarten de Boer

Carnegie Mellon University

Email

Gianluca Piazza

Carnegie Mellon University

Email

David Srolovitz

University of Pennsylvania

Email

Andres Rappe

University of Pennsylvania

Email

Funding Divisions

Civil, Mechanical and Manufacturing Innovation (CMMI)

Although they have fueled a global technology revolution, the electronic transistors that lie at the heart of digital logic in computers are very energy-inefficient. Specifically, the electrically conducting contacting surfaces need to be able to open and close up to a quadrillion times without wearing out or becoming contaminated, and materials that can do this have not yet been developed. This project's objectives are: (1) to understand the failure mechanisms that occur in these switches; and (2) to discover and develop new materials and operating conditions with sufficient reliability. The approach will involve performing computational modeling of failure mechanisms at atomistic scales, and performing nanoscale microscopy experiments. Models and experiments will be integrated for high-throughput screening of materials. A large array of candidate materials will be canvassed, selecting those that possess required characteristics including electrical conductivity, wear resistance, and resistance to oxidation and buildup of contamination. The most promising ones will be tested in prototype nanoscale devices to ultimately identify materials and conditions that enable this new technology. This work will help maintain U.S. competitiveness in information technology by continuing technological progress in a key economic sector.

Publications

Mechanochemical Effects of Adsorbates at Nanoelectromechanical Switch Contacts
F. Yang, J. Yang, Y. Qi, M. P. de Boer, R. W. Carpick, A. M. Rappe, and D. J. Srolovitz
9/24/2019
The strong effect on MEMS switch reliability of film deposition conditions and electrode geometry
C. Oh, C. B. Stovall, W. Dhaouadi, R. W. Carpick, and M. P. de Boer
7/1/2019
Mechanism of Benzene Tribopolymerization on the RuO2 (110) Surface
J. Yang, Y. Qi, H.  . Kim, and A.  . Rappe
4/26/2018
Screened van der Waals correction to density functional theory for solids
J. Tao, F. Zheng, J. Gebhardt, J. P. Perdew, and A. M. Rappe
7/21/2017
Large polarization gradients and temperature-stable responses in compositionally-graded ferroelectrics
A. R. Damodaran, S. Pandya, Y. Qi, S. Hsu, S. Liu, C. Nelson, A. Dasgupta, P. Ercius, C. Ophus, L. R. Dedon, J. C. Agar, H. Lu, J. Zhang, A. M. Minor, A. M. Rappe, and L. W. Martin
5/10/2017
Large-area synthesis of high-quality monolayer 1T’-WTe 2 flakes
C. H. Naylor, W. M. Parkin, Z. Gao, H. Kang, M. Noyan, R. B. Wexler, L. Z. Tan, Y. Kim, C. E. Kehayias, F. Streller, Y. R. Zhou, R. Carpick, Z. Luo, Y. W. Park, A. M. Rappe, M. Drndić, J. M. Kikkawa, and A. T. C. Johnson
2/2/2017
Adsorption of Benzene on the RuO2(110) Surface
H. D. Kim, J. Yang, Y. Qi, and A. M. Rappe
1/13/2017
Ultrafast terahertz-field-driven ionic response in ferroelectric BaTiO3
F. Chen, Y. Zhu, S. Liu, Y. Qi, H. Y. Hwang, N. C. Brandt, J. Lu, F. Quirin, H. Enquist, P. Zalden, T. Hu, J. Goodfellow, M. -. Sher, M. C. Hoffmann, D. Zhu, H. Lemke, J. Glownia, M. Chollet, A. R. Damodaran, J. Park, Z. Cai, I. W. Jung, M. J. Highland, D. A. Walko, J. W. Freeland, P. G. Evans, A. Vailionis, J. Larsson, K. A. Nelson, A. M. Rappe, K. Sokolowski-Tinten, L. W. Martin, H. Wen, and A. M. Lindenberg
11/22/2016
Thin-film ferroelectric materials and their applications
L. W. Martin, and A. M. Rappe
11/15/2016
In situoxygen plasma cleaning of microswitch surfaces—comparison of Ti and graphite electrodes
C. Oh, F. Streller, W. R. Ashurst, R. W. Carpick, and M. P. de Boer
10/18/2016
Stable Phosphorus-Enriched (0001) Surfaces of Nickel Phosphides
R. B. Wexler, J. M. P. Martirez, and A. M. Rappe
7/28/2016
Valence Band Control of Metal Silicide Films via Stoichiometry
F. Streller, Y. Qi, J. Yang, F. Mangolini, A. M. Rappe, and R. W. Carpick
6/23/2016
Monolayer Single-Crystal 1T′-MoTe2 Grown by Chemical Vapor Deposition Exhibits Weak Antilocalization Effect
C. H. Naylor, W. M. Parkin, J. Ping, Z. Gao, Y. R. Zhou, Y. Kim, F. Streller, R. W. Carpick, A. M. Rappe, M. Drndić, J. M. Kikkawa, and A. T. C. Johnson
6/20/2016
Substantial bulk photovoltaic effect enhancement via nanolayering
F. Wang, S. M. Young, F. Zheng, I. Grinberg, and A. M. Rappe
1/21/2016
Polarization Dependence of Water Adsorption to CH3NH3PbI3 (001) Surfaces
N. Z. Koocher, D. Saldana-Greco, F. Wang, S. Liu, and A. M. Rappe
10/21/2015
Novel Metal Silicide Thin Films by Design via Controlled Solid-State Diffusion
F. Streller, R. Agarwal, F. Mangolini, and R. W. Carpick
6/5/2015
Microstructure-sensitive investigation of magnesium alloy fatigue
K. Hazeli, H. Askari, J. Cuadra, F. Streller, R. W. Carpick, H. M. Zbib, and A. Kontsos
5/1/2015
Ferroelectric Domain Wall Induced Band Gap Reduction and Charge Separation in Organometal Halide Perovskites
S. Liu, F. Zheng, N. Z. Koocher, H. Takenaka, F. Wang, and A. M. Rappe
2/5/2015
First-Principles Calculation of the Bulk Photovoltaic Effect in CH3NH3PbI3 and CH3NH3PbI3–xClx
F. Zheng, H. Takenaka, F. Wang, N. Z. Koocher, and A. M. Rappe
12/10/2014
Coexisting Surface Phases and Coherent One-Dimensional Interfaces on BaTiO3(001)
E. H. Morales, J. M. P. Martirez, W. A. Saidi, A. M. Rappe, and D. A. Bonnell
4/28/2014
Contamination Thresholds of Pt- and ${\rm RuO}_{2}$-Coated Ohmic Switches
V. Brand, M. S. Baker, and M. P. de Boer
12/1/2013
The Pulse-Activated Piezo-NEMS Shuttle Relay in 2017 IEEE 17th International Conference on Nanotechnology
Electrostatic Actuation of the Pulse-Activated Piezo-NEMS Shuttle Relay in 2018 IEEE Micro Electro Mechanical Systems

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Designing Materials to Revolutionize and Engineer our Future (DMREF)