Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable...
Transcript of Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable...
![Page 1: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/1.jpg)
Copyright © 2019 Silvaco Inc.
R1
FROM ATOMS TO SYSTEMS
Schottky Contact Revisited
IEEE EDS Workshop 2019, Orme des Merisiers
P. Blaise, PhD, Sr. AE atomistic [email protected]
![Page 2: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/2.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
2
• TCAD flow: Silvaco environment
•Ab initio: 2D-TMD / Metal contact.
• Atomistic TCAD: Victory Atomistic, a new-comer.
PLAN
• TCAD flow: Silvaco environment
•Ab initio: 2D-TMD / Metal contact.
• Atomistic TCAD: Victory Atomistic, a new-comer.
![Page 3: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/3.jpg)
Copyright © 2019 Silvaco Inc.
SILVACO Inc.
Austin, US
Sales
Seoul, KP
Sales
Boston, US
Sales
Grenoble, FR
Sales, R&D
Kyoto, JP
Sales
Cambridge, GB
Sales, R&D
Vienna, AT
R&D
Silicon Valley, US
HQ, R&D, Sales
Moscow, RU
R&D
Copenhagen, DK
R&D
Singapore, SG
Sales
Shanghai, CN
Sales
Shenzhen, CN
Sales
W. Lafayette, US
R&D
Yokohama, JP
Sales
![Page 4: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/4.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
4
Benefits of TCAD
• In order to reduce the development time and costs of semiconductor technologies. The ITRS roadmap indicates that TCAD simulation can reduce the costs of the development cycles by ~30%.
• You can see “inside” the device. Measurements tell you “what” happens, not “why” it happens, TCAD provides the “why” answers.
• You can experiment with the causality of effects If your device exhibits an unexpected characteristic, you can experiment with various theories in TCAD. If one theory matches the measured result, there is a good chance you have found the cause.
• Improves internal company communication Device modifications and their expected effects can be visualized and passed between departments.
![Page 5: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/5.jpg)
Copyright © 2019 Silvaco Inc.
Silvaco TCAD Design Flow
Structure Builder, Process Simulation
Victory Process
Device Simulation
Victory Device
3D RC Extraction
Clever
Layo
ut
Automation and Optimization
2D/3D Visualization
Silvaco TCAD Design FlowTCAD Layout Driven Framework for FEOL and BEOL Simulation Solution.
All in one environment, no need to learn and use multiple tools
![Page 6: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/6.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
6
- 6 -
Wide TCAD Adoption Across Applications
![Page 7: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/7.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
7
Process Simulation
TU Vienna
6 Ph.Ds, for performance improvement of level-set based 3D physical etching, deposition and
oxidation, SiC & GaN process simulation
EU Funded ProjectsDOMINO: Scientist exchange project focused on the
development of compact models for organic and oxide SC based large area electronics (LAE).
ALMA: multiscale modelling of thermal transport in semiconducting materials. Link Boltzmann Transport Equations
(BTE) to TCAD.
Challenge: The development of 3C-SiC based power electronic devices. From growth to device modelling.
1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics.
EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to SPICE.
COST: Multiscale modelling of solar cells.
Device Simulation
TU Vienna 3 Ph.Ds, for advanced MRAM device simulation
MIT 3D GaN FinFET
RIT Design Strategies for Ultralow Power 10nm node FinFETs
UC Davis GaN Device simulation
ASU Diamond-based Device simulation
Kent University Ion transport modeling (Organic Electrochemical transistors)
Projects in preparation
LETI: Nanowire and GaN spice compact model
IMEC: Cryogenic TCAD and modeling Project
Collaborations
![Page 8: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/8.jpg)
Copyright © 2019 Silvaco Inc.
Plan
• TCAD flow: Silvaco environment
•Ab initio: 2D-TMD / Metal contact.
• Atomistic TCAD: Victory Atomistic, a new-comer.
![Page 9: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/9.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
9
My Dipole is a Microscopic Average
(a0)
(e/a
03)
Métal W vide
• Solve the microscopic 3D Poisson equationthanks to a DFT ab initio calculation
+ -
e- spill-out
W slab • After a 2D average procedure, the oscillations related to successive atomicplanes are filtered by several convolutions leading to a macroscopic averaged 1D Poisson equation
![Page 10: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/10.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
10
M-S JUNCTION
m-elec. Solid State Vacuum
• PRB 64 205310, R. Tung: « Formation of an electric dipole at metal-semiconductor interfaces »
• The central quantity is the band offset
Which gives two definitions for the dipole that are related by
![Page 11: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/11.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
11
2D TMD Contact
Top Oxide
Back Oxide
Silicon (Back-gate)
S D
Rext
G
t2D
2D Mat.
- - - - - -+ + + + + +
Interface charge transfer
0.3 1 10 1000
0.5
1
1.5
2
2.5
thickness (nm)
Eg (
eV) GaAs
Si
Ge
InAs
InSb
2DTMDs
tsemi (nm)
3D
E G(e
V)
C. English, E. Pop et al., Nano Lett., (2016)• 3D materials → nanometer scale restricts
band gap and carrier mobility
• 2D solution → atomically thin materials
Transition Metal Di-chalcogenides (ex: MoS2)
![Page 12: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/12.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
12
2D TMD - Metal Dipole
S. V. Suryavanshi et al., IEEE SISC, 2017, 2018, San Diego, CA
• Metal 2D reactivity modulates VdW gap and FB
• DFT simulation: full relaxation with residual strain on metal
• Simulation of FB engineering:
• Point defects
• Impurities
• Intercalation layer
![Page 13: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/13.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
13
2D/Metal Dipole modulation
• Point defect effect on FB is screened by Ti reactivity
• S and Mo effects suggest to intercalate a 2D layer
• Au contact• Ti contact
Eg
FB
(eV
)
FB
(eV
)
![Page 14: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/14.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
14
2D Intercalation layerMetal contact
(hcp-Ti)
TiTe2
Bottom MoS2
(reference)
• Ti contact • Au contact
• P+ : Ti or V substitutes Mo
• N+: Te or Se substitutes S
• 2D intercalation layer stability
![Page 15: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/15.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
15
2D / Metal – Contact ResistanceR
C(Ω·μ
m)
n2D (cm-2)
Ti
Au Gr.
Au Ti
Au Gr.
Ag • Fundamental limit to RC < 10 Ω·μm
• Metal-2D interface has poor transmission
• Reduce the vdW gap and reduce the FB
(follow the ab initio work on interfaces)
• Can we go a step further?
• Quantum transmission:
S. V. Suryavanshi PhD Thesis (Stanford U., E. Pop group)
www.nanohub.org
![Page 16: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/16.jpg)
Copyright © 2019 Silvaco Inc.
Plan
• TCAD flow: Silvaco environment
•Ab initio: 2D-TMD / Metal contact.
• Atomistic TCAD: Victory Atomistic, a new-comer.
![Page 17: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/17.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
17
Victory Atomistic: Nemo5 Pro
Silvaco, Purdue Team Up to Bring Scalable Atomistic TCAD Solutions For Next Generation Semiconductor
Devices And Materials
“The NEMO tool suite represents the spearhead of nanotechnology modeling –both for well-controlled experimental conditions as well as large-scale fabricationreality. Its commercial version, customized to industrial needs and infrastructure,will have high societal impact”, T. Kubis, see:
https://www.purdue.edu/newsroom/releases/2018/Q3/silvaco,-purdue-team-up-to-bring-scalable-atomistic-tcad-solutions-for-next-generation-semiconductor-devices-and-
materials.htmlhttps://www.silvaco.com/news/pressreleases/2018_08_24_01.html
![Page 18: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/18.jpg)
Copyright © 2019 Silvaco Inc. Copyright © 2019 Silvaco Inc.
18
Atomistic Contact Resistivity
NiSi p-Si Contact resistivity as a function of doping for transport along [100], [110] and [111] crystal direction. Transport along [111] offers the lowest resistivity due to the smaller light hole effective mass and higher transverse density of states.
![Page 19: Schottky Contact Revisited · 1D-NEON: Fibre based printed devices (oTFT and oLED) for wearable electronics. EXTMOS: Multiscale modelling of organic based TFTs and LEDs from DFT to](https://reader034.fdocuments.us/reader034/viewer/2022052008/601d8fbf4ff8502d512f5de3/html5/thumbnails/19.jpg)
Copyright © 2019 Silvaco Inc.
R1
FROM ATOMS TO SYSTEMS
Thank you for your attention!