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Forschungszentrum Jülich in der Helmholtz-Gemeinschaft Detlev Reiter Forschungszentrum Jülich GmbH, Institute for Energy and Climate Research 52425 Jülich, Germany ICTP-IAEA Joint Workshop on Fusion Plasma Modelling using Atomic Molecular Data, Trieste 23-27 Jan. 2012 Introduction to edge plasma modelling

Introduction to edge plasma modelling

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Page 1: Introduction to edge plasma modelling

Forschungszentrum Jülich in der Helmholtz-Gemeinschaft

Detlev Reiter

Forschungszentrum Jülich GmbH, Institute for Energy and Climate Research

52425 Jülich, Germany

ICTP-IAEA Joint Workshop on Fusion Plasma Modelling using Atomic Molecular Data, Trieste 23-27 Jan. 2012

Introduction to edge plasma modelling

Page 2: Introduction to edge plasma modelling

Forschungszentrum Jülich in der Helmholtz-Gemeinschaft

Introduction to edge plasma modelling

Like in any applied science: Three questions

I.) WHAT : …happens? A &M & plasma-wall interaction processes

II.) HOW : …can we make the application work? ITER

III.) WHY : understanding the edge plasma,

using A&M&S data in edge plasma modelling

Outline of course:

See other lectures

Some unfinished business

www.eirene.de

www.hydkin.de

Page 3: Introduction to edge plasma modelling

JET, MARK-I,

density ramp-up

-ohmic

-no imp. injection

-simply: D2-puff

Page 4: Introduction to edge plasma modelling

Full detachment is a problem

JET, A. Huber, et al.

[12]

Detachment which is too “strong” (particle flux reduced across the whole target) is often associated with zones of high radiation in the X-point region and confined plasma (MARFE)

MARFE formation can drive a transition from H to L-mode (H-mode density limit) or disruption

MARFE physics still not well understood

Limit detachment to regions of highest power flux (where it is needed most).

Maintain remainder of SOL in high recycling (attached)

A few ways to arrange that this happens more readily:

Divertor closure Target orientation Impurity seeding

Courtesy: R. Pitts

Page 5: Introduction to edge plasma modelling

Divertor closure

Increased closure significantly improves divertor neutral pressure increased neutral density (nn), promoting earlier detachment

Closing “bypass” leaks important for increasing nn

Divertor closure also promotes helium compression and exhaust – very important for ITER and reactors

JET, R. D. Monk, et al.

[13]

Courtesy: R. Pitts

Page 6: Introduction to edge plasma modelling

Target orientation

Parallel heat fluxes significantly reduced for vertical cf. horizontal targets

Underlying effect is preferential reflection of recycled deuterium neutrals towards the separatrix

Neutrals into hotter plasma

near separatrix

Increased ionisation near sep.

Higher nt, lower Tt

Higher CX losses

AUG, A. Kallenbach, et al.

Neutrals into cooler, less

dense plasma

Pressure loss q||

Sepa

ratrix

Courtesy: R. Pitts

Page 7: Introduction to edge plasma modelling

Impurity seeding

JET, G. F. Matthews et al.

Unfuelled

(attached)

Strong D2 puff

(weak detachment)

Strong D2 +N2 puff

(stronger detachm.)

Strong impurity seeding also reduces ELM size but

high price can be paid in confinement

Page 8: Introduction to edge plasma modelling

ITER divertor designed to achieve partial detachment

ITER Divertor DDD 17, Case 489 (SOLPS4.2 runs by A.

Kukushkin)

Deep V-shaped divertor, vertical, inclined targets

Dome separating inner and outer targets – also helpful for

diagnostics, neutron shielding and reducing neutral reflux to

the core

Inner strike pt.

Pow

er lo

ad

(W

m-2)

Outer strike pt.

Courtesy: R. Pitts

Page 9: Introduction to edge plasma modelling

Candle, on earth

Convection, driven by buoyancy

(i.e. gravity)

Only Diffusion (no convection)

Candle, under mircogravity

(only small,

dim burn,

at best)

Fresh air

Us

ed

air

e.g.: parabola flight,

g ≈ 0

Can we hope that magnetic confinement core plasma physics progress

will mitigate plasma-surface problems ?

Page 10: Introduction to edge plasma modelling

Divertor exhaust

Apart from power handling, primary function of

divertor is to deal with He from fusion reactions

compress D, T, and He exhaust as much as

possible for efficient pumping (and therefore also

good density control).

To cryopumps

Critical criterion for an ITER burning plasma

is that He is removed fast enough such that:

is satisfied.

is the global helium particle residence

time – a function of tp, the He neutral

density in the divertor and the pumping

speed (conductance) .

Helium

enrichment:

is the ratio of He concentration in the

divertor compared to the main plasma.

105/*

, EHep tt

plasma

pump

e

plasma

He

pump

D

pump

HeHe

C

C

nn

nn

/

2/ 2

*

,Hepte.g. ITER: He prod. rate ~21020s-1

Max. divertor pumping speed

~200 Pa m3s-1 ~ 11023 He atom s-1

Cpump ~ 210-3 = 0.2%

Typical acceptable He conc. in the

core: ~4% He = 0.2/4 = 0.05 is

minimum required. The values of

and required for ITER have

been achieved experimentally

*

,Hept He

Courtesy: R. Pitts

Page 11: Introduction to edge plasma modelling

Opacity in Fusion edge plasmas?

Only for resonance lines: Lyman-series

Page 12: Introduction to edge plasma modelling

12

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

The Photon mean free path

]cm[n

T108.1n

T104.5mfp

a

13

1

a

2/1

0

9

0

Ly- Doppler Profile (5 eV) 10 cm

30 cm

50 cm mfp for na=1013

eV

At line centre:

for Lyman lines

Page 13: Introduction to edge plasma modelling

13

Experimental observations

Terry et al, PoP 5,5 (1998) 1759:

Alcator C-Mod:

clear evidence for strong opacity effects

Ratio: Lyman- /Balmer-: proof of opacity

ne: low

ne: high

Lyγ

remains opt. thin

Page 14: Introduction to edge plasma modelling

14

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

Norm

alis

ed a

bsorp

tion

- an

d e

mis

sion l

ines

hap

es

[eV]

H D T

1 eV

10 eV

Lyman- Voigt-Lineshapes mfp

1~ (Photon mean-free-path)-1

Page 15: Introduction to edge plasma modelling

15

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

April 29th 2002

Escape factors: zero dimensional corrections

to account for radiation trapping

Line escape factors:

for line of sight spectroscopy

(provided also by EIRENE, with zero statistical noise)

Population escape factors:

modify ionisation-recombination balance.

Important for dynamics in detached plasmas

E

G

rj

ddrIrr line

P

1)(4

),()(1)( 4

ikPik ArA )(

Page 16: Introduction to edge plasma modelling

16

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

April 29th 2002

Comparison: ADAS vs. EIRENE escape factors

long cylinder case, homogeneous plasma

pure Doppler broadening (kT = 1 eV)

EIRENE population escape factor evaluation

(Optical thickness)

Page 17: Introduction to edge plasma modelling

17

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

April 29th 2002

Comparison of D atom profiles

before after

Page 18: Introduction to edge plasma modelling

18

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

April 29th 2002

Lyman- photon density (log scale), after iteration

Page 19: Introduction to edge plasma modelling

19

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

April 29th 2002

population escape factor

Page 20: Introduction to edge plasma modelling

A.S. Kukushkin, 12th PET, Rostov, Russia, 2nd September 2009 (ITER_D_2NJZH5) Page 20

A.Kukushkin, PET 2009 Episode 11: radiation transport

Partial detachment, high nneut Lyman series radiation MFP < 1 cm strong increase of ionisation, change of ionisation/recombination balance

Radiation transport in Eirene: several Ly series, photons like neutrals

SOLPS calculations: no effect on qpk and nHe, although plasma parameters in divertor change strongly

Reason: stronger ionisation in cold region increase of n increase of recombination (Sion n2; Srec n3)

Important for diagnostics, less for performance

don’t trust simple models!

dome, n-n D+He add Lyman trans.

0.001

0.01

2 4 6 8 10

30

5_

C0

_n

t_ly

_z0

8_

1

nHe_sep

[1020m-3]

pDT

[Pa]

1

10

2 4 6 8 10

30

5_

C0

_n

t_ly

_z1

1_

1

qpk

[MW/m2]

pDT

[Pa]

Page 21: Introduction to edge plasma modelling

Why do edge codes take forever to

converge ?

Page 22: Introduction to edge plasma modelling

wall

plasma core

target

target

10 m

10 cm

recycling

Major radius = 2-6 m

(distance to torus center)

A simple model, to illustrate the numerical challenge

B

Plasma flow

Gas flow

Page 23: Introduction to edge plasma modelling

The often hidden challenge: code convergence, iterating on noise ??,…..

Code performance: Plasma Flow alone, B2, serial

B2, without EIRENE

1.00E-11

1.00E-09

1.00E-07

1.00E-05

1.00E-03

1.00E-01

1.00E+01

1.00E+03

1.00E+05

0 500 1000 1500 2000 2500 3000

no. of timesteps

resid

ual

(1/s

ec)

resee

resei

resco

resmo

Expected uncritical behavior, errors reduced exponentially to machine

precision.

Numerical Convergence errors (residuals)

during CFD run, vs. timestep Part. Balance (D+)

En. Bal (D+)

En. Bal. (electrons)

Moment. Balance

(Navier Stokes)

Page 24: Introduction to edge plasma modelling

convergence behaviour of the coupled

B2-EIRENE codesystem (1)

coupled B2-EIRENE calculation,

recycling coefficient R=0.3

1.E-03

1.E-02

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

1.E+05

0 200 400 600 800 1000

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

B2 with analytic recycling model

(without EIRENE),

recycling coefficient R=0.3

1.E-03

1.E-02

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

1.E+05

0 200 400 600 800 1000

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

B2, R=0.3 B2-EIRENE, R=0.3

This is what we want (Analytic recycling model=

unrealistically simplified Boltzmann eq.)

And this is what we get (full Boltzmann eq., Monte Carlo)

Numerical Convergence errors (residuals)

during CFD run, vs. timestep

Page 25: Introduction to edge plasma modelling

Code performance: serial, B2-EIRENE, ITER test case, Linux PC 3.4 GHz

(typical for all “micro macro models” in computational science)

0.01

0.1

1

10

100

1000

10000

0 500 1000 1500 2000

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

3h 15h 150h =

6.25 days

10s per EIRENE call

100s per

EIRENE call 1000s per

EIRENE call

Convergence limited by statistical Monte Carlo noise.

In order to reduce error by factor 10, runtime

(or number of processors) has to be increased by factor 100

What is a measure for: Performance ? Convergence ?

Comp. Sci + appl. Math.

Page 26: Introduction to edge plasma modelling

convergence behaviour of the coupled

B2-EIRENE codesystem (2)

coupled B2-EIRENE calculation,

recycling coefficient R=0.99

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

1.E+05

0 500 1000 1500

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

coupled B2-EIRENE calculation,

recycling coefficient R=0.3

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

1.E+05

0 500 1000 1500

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

10s per EIRENE call

100s per

EIRENE call

3 h

15 h

low recycling high recycling

Convergence in given CPU-time depends

on level of recycling (= vacuum pumping speed)

3 h

15 h

Page 27: Introduction to edge plasma modelling

convergence behaviour of the coupled

B2-EIRENE codesystem (3)

Total particle content

Recycling coefficient R=0.3

5.2E+20

5.3E+20

5.4E+20

5.5E+20

0 500 1000 1500

no. of timesteps

part

icle

co

nte

nt

(#/m

**3)

Total particle content

Recycling coefficient R=0.99

5.2E+20

6.2E+20

7.2E+20

8.2E+20

0 500 1000 1500

no. of timesteps

part

icle

co

nte

nt

(#/c

m**

3)

Total energy content

Recycling coefficient R=0.3

1.5E+04

2.0E+04

2.5E+04

3.0E+04

3.5E+04

4.0E+04

4.5E+04

5.0E+04

0 500 1000 1500

no. of timestepsen

erg

y c

on

ten

t

electron energy

ion energy

Total energy content

Recycling coefficient R=0.99

1.5E+04

2.0E+04

2.5E+04

3.0E+04

3.5E+04

4.0E+04

4.5E+04

5.0E+04

0 500 1000 1500

no. of timesteps

en

erg

y c

on

ten

t

electron energy

ion energy

low recycling

R=0.3

high

recycling

R=0.99

“Is is enough to see one lion to know you are in a desert”

Page 28: Introduction to edge plasma modelling

Correlation sampling and convergence of B2-EIRENE

Here: correlation produced by simple manipulation of random

number generator

coupled B2-EIRENE calculation,

recycling coefficient R=0.3

with correlation sampling

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

0 200 400 600 800 1000

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

coupled B2-EIRENE calculation,

recycling coefficient R=0.3

without correlation sampling

1.E-01

1.E+00

1.E+01

1.E+02

1.E+03

1.E+04

0 200 400 600 800 1000

no. of timesteps

resid

ual (1

/sec)

resee resei resco resmo

Without correlation sampling cpu time has to be increased by a factor 100 to reach the

same convergence level !

How much correlation ? Damping of noise, without freezing error from early iterations.

Page 29: Introduction to edge plasma modelling

Recent Progress and Challenges

Going from 2D 3D…..

Page 30: Introduction to edge plasma modelling

30

Trilateral Euregio Cluster

TEC

Inst itut für PlasmaphysikAssoziat ion EURATOM-Forschungszentrum Jülich

The experimental experience:

to stir a liquid

Creating turbulent (chaotic) flow

can largely increase heat transfer

(avoid local overheating)

The theory:

“passive scalar transport in chaotic force fields”

Not yet understood on a quantitative level

very active modern research field of

•theoretical physics

•large scale numerical computing.

Page 31: Introduction to edge plasma modelling

Avoid excessive heat loads by stirring (magnetically) the plasma?

TEXTOR-DED: Dynamic Ergodic Divertor

Page 32: Introduction to edge plasma modelling
Page 33: Introduction to edge plasma modelling

13th of April 2011

Dynamic Ergodic Divertor (DED) in TEXTOR

flexible tool to study the impact of resonant magnetic perturbations on

transport, stability and structure formation (helical divertor)

C - EmissionIII

m/n=12/4 m/n=6/2

C - EmissionIII

m/n=3/1

C - EmissionIII

16 coils mounted at the HFS:

- covered with graphite tiles

- helical set-up

- resonant on q=3 surface

different operation modes:

DC operation

AC operation [1-10kHz]

slow strike point sweeps

resonant perturbation:

- m/n = 12/4, 6/2, 3/1 base mode

- different penetration depth

- B /B ~ 10% DED q

Page 34: Introduction to edge plasma modelling

D.Harting, D.Reiter, JUEL-4173, May 2005

Field line tracing- 3D plasma fluid –neutral gas kinetic modeling

Partially ergodic 3D magnetic field topology

3D edge codes also Monte Carlo for plasma flow fields (EMC3)

TEXTOR-DED B-Field (R-Z) TEXTOR-DED B-Field (r-θ)

Page 35: Introduction to edge plasma modelling
Page 36: Introduction to edge plasma modelling

“Particle” methods:

also well established in fluid dynamics

• Lagrangian method Eulerian (grid based) method

• Advantages:

• + concentrate “particle” in the interesting region

• + Convective transport essentially without numerical dissipation in arbitrarily complex geometry

• Disadvantages:

• - Non-convective terms (collisions, diffusion)

• Solution: Monte Carlo fluid (random walk model)

• in Fusion: this is the concept of E3D and EMC3-EIRENE codes (IPP Greifswald)

• - looses accuracy in region of interfacial boundaries

Page 37: Introduction to edge plasma modelling

EMC3-EIRENE: FZJ: mainly tokamak applications (RMPs)

Example: DIII-D ELM mitigation scenarios

Goal: quantify PSI, when RMPs are applied in ITER

Page 38: Introduction to edge plasma modelling

Electron Temperature, DIII-D, with RMPs

(initially developed for stellarator applications

W7AS, W7X, LHD) was advanced to a

more flexible grid structure to allow divertor

tokamak + RMP applications. first self-consistent 3D plasma and neutral gas transport simulations for poloidal divertor tokamak configurations with RMPs.

Simulation results for ITER similar shape plasmas at DIII-D show a strong 3D spatial modulation of plasma parameter, e.g. in T

e.

EMC3-EIRENE code verification (by benchmarks with 2D tokamak edge codes) and validation (TEXTOR, DIII-D, JET, LHD experiments) ongoing

EMC3-EIRENE is currently being used for contractual ITER RMP design studies (jointly by FZJ and IPP, 2010-2012)

Te,1

= 60 eV T

e,2 = 120 eV

Te,3

= 200 eV

Towards fully 3D CFD: The EMC3-EIRENE code (IPP Greifswald – FZ-Juelich)

Page 39: Introduction to edge plasma modelling

Atomic database, as currently used

Page 40: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 40

This work: “plasma chemistry modeling

for magnetic fusion devices”

Page 41: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 41

Many, external resources

www hydkin.de

B2-EIRENE

Many,

often

Matlab

Page 42: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 42

www.eirene.de/A+Mdata

www.hydkin.de

Page 43: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 43

www.eirene.de/A&Mdata

Page 44: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 44

www.eirene.de A&M&S Data BCA: TRIM

All data, figs,

and references:

HERE

Page 45: Introduction to edge plasma modelling

www.eirene.de: online (TRIM) reflection database

Data files with tables of

reflection distributions,

e.g. for particle simulation codes (conditional quantile format)

Page 46: Introduction to edge plasma modelling

Backscattering

Dependency of reflection coefficient on incident energy

1 10 100 10000.00

0.05

0.10

0.15

0.20

Re

fle

cti

on

co

eff

icie

nt

R

Incident energy [eV]

Monte Carlo simulation (BCA): C on C, in = 60°

At low energies:

BCA not valid

Molecular Dynamic

calculations yield

R 0

Plasma-Wall Interaction Processes

Page 47: Introduction to edge plasma modelling

Particle reflection coefficient, D --> FE, 30 degree

0.0

0.1

0.2

0.3

0.4

0.5

0.6

0.7

0.8

0.9

1.0

1 10 100 1000 10000

eV

Eckstein 1983

TRIM-1985

TRIM-2002

SDTrimSP 2007

Sensitivity of reflection coefficient at low Ein (all within BCA, TRIM)

Incident energy,

Uncertain

MD ??

Quite reliable,

BCA

Hidden key parameter:

Surface binding energy ( from MD?)

Page 48: Introduction to edge plasma modelling

TRIM.xxx: reflected energy spectra

red: 200.000 TRIM particles,

blue: reconstructed from 10 quantiles

Challenge: what is the minimal dataset that allows

to re-sample the full backscattering (and sputtering) Eout,Θout-distribution ?

See:

www.eirene.de

Surface data

TRIM

E

EER inin

);,( q

Page 49: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 49

TRIM-codes family, online database

for fully kinetic reflection velocity space PDFs

Particle reflection coefficient, D --> FE, 30 degree

0.0

0.1

0.2

0.3

0.4

0.5

0.6

0.7

0.8

0.9

1.0

1 10 100 1000 10000

eV

Eckstein 1983

TRIM-1985

TRIM-2002

SDTrimSP 2007

Page 50: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 50

Storing full 3D pdf of reflected

particles, for given incident

energy (12) and angle (7)

i.e. 84 tables for each

target-projectile combination

Next: similar database for

sputtering.

TRIM database (www.eirene.de)

Page 51: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 51

Goal: replace various scalings (e.g. Yamamura

for incident angle dependence) by full database,

same format as for EIRENE-reflection database

Still not decided:

how to parameterize

a) Surface roughness,

b) Material mixing

Universal sputtering law: Janev, Ralchenko, et al.

for normal incidence yield.

0 degree

80 degree incident angle

Sputter yield database

For normal incidence:

probably ok.

Lost information, due to

raw data processing at too early stage

Page 52: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 52

www.eirene.de A&M Data HYDHEL, AMJUEL

All data, figs,

and references:

HERE

Page 53: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 53

1986 -…., Polynomial fits

Automated

Interface to

EIRENE

History A&M Data, H and He, in EIRENE (=current status in ITER modelling)

1987 -…. He, He*, He+

Metastable

resolved.

Polyn. Fits

produced,

Elec. Cooling

rates added

H, H* , H+,

H2, H2+

2000 -….

Rad. transfer

Lyman opacity

added

1983 - 1999

Johnson-Hinnov

CR model for

H,H* H+

Page 54: Introduction to edge plasma modelling

www.hydkin.de

Online data base

and data analysis tool-box:

- CR model condensation

- Sensitivity analysis

- Fragmentation pathway analysis

- Reduced models

• Hydrocarbons

• Silanes

• H, H2, H3+,….

• W, W+, ….W 74+

• N, N2

Basic input for ITER divertor code: A&M data, ( & surface data)

Goal: publicly expose raw data used in any modelling

Next GOAL: BeH, BH, ……

Page 55: Introduction to edge plasma modelling

A: constructed from reaction rates for losses and gains of population y

(Maxw. reaction rates are obtained by integration of reaction cross sections, “on the fly”)

Gas puff, chem. sputtering Transport losses

HYDKIN: select a number of species,

and a set of reactions. Then:

Page 56: Introduction to edge plasma modelling

NEW: surface reflection database

NEW: added after Juel-Reports and

PoP papers

Page 57: Introduction to edge plasma modelling

Choose plasma background

Integration time

Graphical presentation

Page 58: Introduction to edge plasma modelling

Printout:

Reflect input as selected

(composition, initial condition,

Influx, transport losses, per species)

Printout:

All individual rates used

Output for interface to EIRENE

Page 59: Introduction to edge plasma modelling

Solution, vs. time (distance)

Here: 0 1e-4 s

Species selected for printout and plotting

Page 60: Introduction to edge plasma modelling

Online solution of time-dep. (1D) Hydrocarbon breakup,

for any prescribed divertor plasma conditions, up to C3H8

Same, integration time 0 1e-3

Runtime of online code is independent

of chosen time interval for integration

(same for 1e-6 or 1e+6 s integration period),

time dependent solution is given fully explicitly in

terms of A matrix elements (+ initial cond.)

If A matrix is upper triagonal, all eigenvalues

and eigenvectors are explicitly given

Closed form analytic solution for Hydrocarbons: Phys. Scr. T138 (2009) 014014

Page 61: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy Research – Plasma Physics | Association EURATOM – FZJ No 61

raw data

HYDKIN

database

toolbox

EIRENE

3D Monte Carlo

kinetic transport

Interface

2004 -- ……(ongoing)

TEXTOR, JET,

ASDEX, DIII-D,

JT-60, LHD, ….. ITER

Spectral (time scale) analysis

fragmentation pathways

Sensitivity analysis

Page 62: Introduction to edge plasma modelling

Verify Interface: HYDKIN --- EIRENE

(check for correct transfer of chemisty,

correct integration of cross sections)

Periodic BC Periodic BC

EIRENE: Make one grid cell, homogeneous plasma,

source of CH4 somewhere in box, run Monte Carlo

e.g. point source of CH4 Mostly H from CH4 fragmentation

focus stat. weights on

C containing fragments

Page 63: Introduction to edge plasma modelling

1 eV, 1000 Eirene particles (<< 1 sec cpu)

0.0E+00

1.0E+07

2.0E+07

3.0E+07

4.0E+07

5.0E+07

6.0E+07

7.0E+07

0.0E+00 1.0E-04 2.0E-04 3.0E-04 4.0E-04 5.0E-04 6.0E-04 7.0E-04 8.0E-04 9.0E-04 1.0E-03

time (s)

C Hydkin

CH Hydkin

CH_2 Hydkin

CH_3 Hydkin

CH_4 Hydkin

C Eirene

CH Eirene

CH_2 Eirene

CH_3 Eirene

CH_4 Eirene

Choose in HYDKIN and in EIRENE:

same Influx: CH4, density: 5e12 cm-3 , Te=Ti=1 eV, same [0,tmax] time period

Density of CHx vs. time

Page 64: Introduction to edge plasma modelling

1 eV, 1000000 Eirene particles (~23 sec cpu)

0.0E+00

1.0E+07

2.0E+07

3.0E+07

4.0E+07

5.0E+07

6.0E+07

7.0E+07

0.0E+00 1.0E-04 2.0E-04 3.0E-04 4.0E-04 5.0E-04 6.0E-04 7.0E-04 8.0E-04 9.0E-04 1.0E-03

time (s)

C Hydkin

CH Hydkin

CH_2 Hydkin

CH_3 Hydkin

CH_4 Hydkin

C Eirene

CH Eirene

CH_2 Eirene

CH_3 Eirene

CH_4 Eirene

Page 65: Introduction to edge plasma modelling
Page 66: Introduction to edge plasma modelling

Spectral analysis:

Identification of reduced models:

ILDM

Page 67: Introduction to edge plasma modelling

Very complex reaction chains (approx. 500 individual processes)

in fusion plasmas: catabolic sequence dominant, little: anabolism Eigenmode analysis of reaction rate equations very simple:

Define “Stiffness parameter”: λmax/ λmin,, ratio of max. to min. eigenvalues

fast slow

Page 68: Introduction to edge plasma modelling

ILDM

Combustion and flame modelling is mathematically analog

to diffusion-reaction modelling of ITER divertor detachment.

Unfortunately: reduced models („intrinsic low dimensional manifolds, ILDM“)

only applicable at very low plasma temperatures

Full reaction

kinetics required

Spe

cie

s t

o b

e r

eta

ined

Page 69: Introduction to edge plasma modelling

importance of CX-DR over DE-DI channels: put one CxHy into plasma. How many e,p pairs are neutralized?

p+CxHy H + CxHy+, CxHy

+ DR

DE, DI CX, DR

Page 70: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 70

Molecular Data analysis (www.HYDKIN.de):

ITM , IAEA

CH4 C2H6 C3H8

DE RKJ 2009 JR 2004 JR 2004

DE+ RKJ 2009 JR 2004 JR 2004

I-DI RKJ 2009 RKJ 2009

## JR 2004 ##

DI+ RKJ 2009 JR 2004 # JR 2004 #

CX-PR JR 2002 JR 2004 JR 2004

R-DR JR 2002 RKJ 2009 RKJ 2009

JR

2002

R. K. Janev and D. Reiter, Phys. Plasmas 9,

4071 (2002);

JR

2004

R. K. Janev and D. Reiter, Phys. Plasmas 11,

780 (2004)

RKJ

2009

D. Reiter, B. Küppers, R. K. Janev, Hydrocarbon

collision database: revisions, upgrades and

extensions, Atomic and Plasma-Material

Interaction Data for Fusion, Vol 16, International

Atomic Energy Agency (IAEA), Vienna, (2010)

# new experiments planned in 2010, Univ. Louvian la Neuve, P. Defrance et al.

# # Revision planned in 2010, Univ. Innsbruck, T. Märk et al

DE: Dissociative excitation of neutral molecules

DE+: Dissociative excitation of molecular ions

I-DI: Ionisation and Dissociative Ionisation of neutral molecules

DI+: Dissociative Ionisation of molecular ions

CX-PR: Charge exchange and particle re-arrangement

R-DR: Recombination, Dissociative Recombination

2010

Upgrade disabled:

published exp. Data

inconsistent

2010

Upgrade ongoing:

Mainly: more low T

reactions:

Particle exchange

Page 71: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 71

2010: more (DR) channels for Geroe Band emission added

Page 72: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 72

New class of processes in thermal region

May 2011

Page 73: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 73

previous database

New class of

processes (2011),

thermal region,

data from Astrophysics

Old: cx

Page 74: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 74

How sensitive is a result to particular process

reaction rates (or transport losses) ?

Define sensitivity Z of density nj wrt. reaction rate Rk

as logarithmic derivative:

Z = d (ln nj) / d (ln Rk)

For n species in the system, and m different processes active,

there are n x m such sensitivity functions.

Fortunately: the system of DGL for these Z has the same form as

that for the densities n, and can also be solved in closed form

using the known eigenvalues and eigenvectors.

If this option is activated, HYKIN prints and plots the s (input)

largest (at t=tmax) such sensitivity functions

Phys. Scr. T138 (2009) 014014

Page 75: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 75

HYDKIN.de: online sensitivity analysis

Analytic solution for sensitivity,

online

Zjk(t)=d(ln[nj])/d(ln<ratek>)

Identify, print and plot the most

sensitive parameters:

If <ratek> changes by x %

Then nj changes by x * Zjk %

Breakup of CH4 @ 40 eV

(143 parameters)

At 40 eV (TEXTOR)

Only DE, I, DI processes are relevant,

(nearly) no dependence on transport at all

D.Reiter et al., Phys. Scr. T138 (2009) 014014

Page 76: Introduction to edge plasma modelling

Detlev Reiter | Institute of Energy and Climate Research – Plasma Physics | Association EURATOM – FZJ No 76

HYDKIN.de: online sensitivity analysis D.Reiter et al., Phys. Scr. T138 (2009) 014014

Identify, print and plot the most

sensitive parameters:

If <ratek> changes by x %

Then nj changes by x * Zjk %

Breakup of CH4 @ 2 eV

(143 parameters)

At 2 eV (detached divertor, PSI-2)

Only CX, DR processes are relevant,

strong dependence on transport details

Analytic solution for sensitivity,

online

Zjk(t)=d(ln[nj])/d(ln<ratek>)

Page 77: Introduction to edge plasma modelling

Conclusions/Outlook

Similar to previous steps: progress to ITER is based mainly on experimental and empirical extrapolation

guided by theory and aided by modelling

Present goal:

include all of edge physics that we are sure must be operative (opacity, A&M physics, surface processes, drifts…, even while our capability to confirm these directly remains limited.

Codes = bookkeeping tools

Present upgrading:

- low temperature plasma chemistry

- consistent wall models

- drifts and electrical currents in the edge

- 2D 3D

- coupling to first principle edge turbulence codes

- code integration: Core- ETB – Edge (ELM modelling)