6677

Webpage renewal

Last Post : March 18, 2016 (Fri) 11:38:18

0

administrator

6676

管理者からのお知らせ

Last Post : March 18, 2016 (Fri) 11:34:46

0

管理者

6675

Approximations

Last Post : February 25, 2016 (Thu) 17:57:59

0

Mariem

6668

Band structure

Last Post : January 27, 2016 (Wed) 10:19:47

3

Goumrhar Faycal

6667

convergence criterion & charge difference

Last Post : December 17, 2015 (Thu) 00:28:09

0

Mariem

6666

Cannot reproduce the bandgap of CuGaTe2

Last Post : November 25, 2015 (Wed) 13:12:16

0

The 27th CMD workshop participant

6664

***err in fczero...root finding fails

Last Post : November 13, 2015 (Fri) 11:20:07

1

Changhoon Lee

6663

LDA-SIC Self-Interaction Correction

Last Post : October 08, 2015 (Thu) 17:38:04

0

Karim

6659

Gap energy Eg

Last Post : September 29, 2015 (Tue) 15:30:30

3

Mariem

6645

LDA-SIC

Last Post : September 06, 2015 (Sun) 10:47:11

1

Karim

6644

Subroutine magnetic moment

Last Post : August 29, 2015 (Sat) 17:44:29

0

Karim

6643

magnetic moment

Last Post : September 06, 2015 (Sun) 10:32:44

1

karim

6639

plotting DOS

Last Post : September 24, 2015 (Thu) 11:46:58

14

Karim

6637

***err in cstate...no convergence***

Last Post : July 30, 2015 (Thu) 07:52:06

1

Ismail

6634

***err in specx...msizmx too small

Last Post : July 12, 2015 (Sun) 07:05:05

2

Olidereus

6626

I've got un errer of msizmx

Last Post : July 05, 2015 (Sun) 23:12:02

2

Ayoub

6623

running executable

Last Post : July 01, 2015 (Wed) 20:31:10

2

Karim

6620

Akai-KKR code: the meaning of some parameters in code

Last Post : May 31, 2015 (Sun) 13:47:20

1

mariem

6619

Convergence in CeFe11Ti

Last Post : May 31, 2015 (Sun) 07:42:42

1

halil

6616

how to set internal parameter in specx.f for different system

Last Post : May 07, 2015 (Thu) 17:12:02

2

Bin

6614

Question About atomic coordinate

Last Post : July 09, 2015 (Thu) 08:15:11

2

Bin

6607

Ni3V no convergence

Last Post : April 28, 2015 (Tue) 23:52:00

6

Bin

6605

Nd-Fe-B Convergence

Last Post : March 25, 2015 (Wed) 05:39:17

1

convergence

6603

bilayer structure

Last Post : February 19, 2015 (Thu) 18:47:57

0

phtstudent

6602

how can i calculate the coupling constant from the code kkr??

Last Post : February 13, 2015 (Fri) 19:46:53

0

bibicha

6586

what the output file can give as an information???

Last Post : February 12, 2015 (Thu) 00:13:24

14

bibicha

6585

value of the spin and the coupling?,

Last Post : January 15, 2015 (Thu) 22:29:19

0

bibicha

6584

the magnetic moment per atom for a given structure??

Last Post : January 15, 2015 (Thu) 22:24:24

0

bibicha

6574

i got this error (rr in genrpt...nrpt too large) how can i fix it ?

Last Post : January 16, 2015 (Fri) 19:55:28

9

bibicha

6568

How to set atomic magnetic moment by AkaiKKR?

Last Post : October 01, 2014 (Wed) 23:34:24

0

Liu.B.H

6561

How to Use " ngo "

Last Post : November 03, 2014 (Mon) 14:08:51

5

Yamamoto

6548

コンパイル

Last Post : August 05, 2014 (Tue) 00:32:50

5

hiro

6546

Correlation function

Last Post : July 22, 2014 (Tue) 13:10:51

0

Koji Kobashi

6543

Job submission

Last Post : June 15, 2014 (Sun) 21:31:09

0

ABRAIME

6542

can kkr-cpa-lda be used in calculate the elastic constants？

Last Post : July 21, 2014 (Mon) 15:51:47

1

chenzuhua

6462

エラーについて

Last Post : March 16, 2014 (Sun) 21:34:53

1

OPU

6460

Specx.f file

Last Post : March 16, 2014 (Sun) 22:37:21

1

DoDo

6459

How can i calculate cohesive evergy?

Last Post : July 22, 2014 (Tue) 13:23:21

3

DoDo

6458

Plotting partial DOS

Last Post : March 16, 2014 (Sun) 21:40:43

1

RKThapa

6457

Compiling errorss of the cpa2002v009c

Last Post : March 16, 2014 (Sun) 22:38:33

1

Hongguo Zhang

6450

magnetic exchange parameters

Last Post : September 30, 2013 (Mon) 19:54:32

0

Mourad

6449

magnetic exchange parameters

Last Post : September 30, 2013 (Mon) 19:54:21

0

Mourad

6448

cpa examples

Last Post : March 16, 2014 (Sun) 22:49:06

1

Mourad

6447

Plotting DOS

Last Post : March 16, 2014 (Sun) 22:54:44

1

abdou

6441

compiling error

Last Post : September 09, 2013 (Mon) 16:26:42

0

M. Inukai

6393

Primitive translation vectors

Last Post : June 28, 2013 (Fri) 11:38:18

1

Imada

6355

DOS and band structure over the Fermi level (in japanese)

Last Post : March 16, 2014 (Sun) 23:14:01

3

Hitoshi GOMI

6309

error installation

Last Post : January 13, 2013 (Sun) 13:21:47

2

error installation

6308

error installation

Last Post : October 03, 2012 (Wed) 22:54:19

0

error installation

6292

Let me know the cited papers

Last Post : January 13, 2013 (Sun) 13:29:52

1

Masanori Hara

6288

Can KKR methoud give a better band gap for semiconductor compared with LDA?

Last Post : August 14, 2014 (Thu) 19:14:04

4

tfl

6227

Energy band plot

Last Post : November 14, 2014 (Fri) 15:40:02

11

Koji Kobashi

6221

DOS plot (1) Outline

Last Post : July 22, 2014 (Tue) 13:06:38

6

Koji Kobashi

6220

LDA SIC

Last Post : April 12, 2012 (Thu) 23:08:47

0

El Kébir HLIL

6219

how to calculate the local moment disorder(LMD) state?

Last Post : April 12, 2012 (Thu) 11:12:17

0

bird

6216

Error as compiling cpa2002v009c package

Last Post : May 20, 2012 (Sun) 19:46:39

1

Khanh Duc

6172

LDA SIC

Last Post : January 13, 2012 (Fri) 01:53:17

0

phdstudent

6157

GMR

Last Post : December 21, 2011 (Wed) 09:53:02

0

p.lim

6078

Plotting Dos

Last Post : May 20, 2012 (Sun) 19:50:42

2

Mourad

6071

Plotting energy bands

Last Post : May 20, 2012 (Sun) 19:52:33

1

Thapa

6070

Physics

Last Post : May 20, 2012 (Sun) 19:54:02

1

Ram Kumar Thapa

6028

Calculations of 4f systems

Last Post : July 25, 2011 (Mon) 16:37:24

0

Jerzy Goraus

6027

Calculation of Edlm

Last Post : July 18, 2011 (Mon) 20:59:13

0

phdstudent

6026

thin film

Last Post : July 15, 2011 (Fri) 19:22:18

0

halimazaari

6023

vacacies Oxygen

Last Post : June 23, 2011 (Thu) 00:03:22

0

phdStudent

6019

Band structure calculation

Last Post : June 06, 2011 (Mon) 14:47:34

0

Krit

6018

KKR-CPA with Phonopy?

Last Post : May 26, 2011 (Thu) 01:03:22

0

iamikaruk

6015

Input for multilayers

Last Post : May 17, 2011 (Tue) 00:45:01

0

phd-student

6014

Calculation Edlm and Efm

Last Post : May 17, 2011 (Tue) 00:36:21

0

phd-student

6013

LDA-SIC (Self Interaction Corrected)

Last Post : May 13, 2011 (Fri) 17:43:22

0

Boujnah

6011

SELF interaction correction

Last Post : May 12, 2011 (Thu) 23:32:30

0

abd

6007

Magnetic exchange parameters

Last Post : April 12, 2011 (Tue) 07:40:14

0

NS

5979

about calculated charges

Last Post : February 07, 2011 (Mon) 01:20:35

0

Dariusz Chrobak

5967

Will you give me some references using Akai KKR as the calculation method

Last Post : January 04, 2011 (Tue) 15:56:08

0

studyphy

5961

convergence problem

Last Post : September 25, 2014 (Thu) 22:08:46

1

abdelfattah elamiri

5960

how to get the spin polarization and about the caculation result of DOS

Last Post : September 14, 2011 (Wed) 11:46:37

1

studyphy

5958

SOS About installation

Last Post : October 17, 2012 (Wed) 09:55:04

2

studyphy

5922

m resolved partial DOS

Last Post : July 09, 2015 (Thu) 18:35:35

4

Jerzy Goraus

5900

gnuplot

Last Post : October 05, 2010 (Tue) 19:38:11

0

putty SSH

5801

Electron density distribution(in Japanese)

Last Post : May 21, 2011 (Sat) 20:50:36

5

Masahiro Tanaka

4924

Bug fix information

Last Post : July 07, 2010 (Wed) 00:09:37

0

H. Akai

288

compilation errors

Last Post : February 02, 2009 (Mon) 04:32:08

0

zanat

284

calculation about ferromagnetism and antiferromagnetism

Last Post : January 10, 2009 (Sat) 18:32:04

2

Teppei Muramatsu

282

CPA2002v009c is released

Last Post : November 05, 2008 (Wed) 23:00:49

0

H. Akai

280

err in atmrot...procedure fails

Last Post : October 21, 2008 (Tue) 15:40:23

0

Dariusz Chrobak

278

Installation error in linux platform(Fedora5)

Last Post : June 11, 2008 (Wed) 15:47:32

0

Moshiour Rahaman

276

executing error

Last Post : May 15, 2008 (Thu) 16:44:05

0

Dariusz Chrobak

272

cpa2002v009b released

Last Post : February 28, 2008 (Thu) 19:06:14

0

akai

270

Sites and atomic positions (in English)

Last Post : March 08, 2008 (Sat) 20:14:05

3

Haris

267

what is wrong with my calculation?

Last Post : February 13, 2008 (Wed) 12:56:53

2

phyfsw

265

How to download machikaneyama2000?

Last Post : November 04, 2008 (Tue) 17:14:15

1

wuzhaofeng

264

condensed physic

Last Post : November 15, 2007 (Thu) 16:47:31

0

wuzhaofeng

263

how to do codoped dms

Last Post : September 29, 2007 (Sat) 10:41:16

0

smail

262

How to calculate the energy of the LMD state?

Last Post : September 26, 2007 (Wed) 18:06:33

0

phyfsw

261

how to calculate the energy of the LMD(local moment disorder)state for Fe-doped GaN system

Last Post : September 26, 2007 (Wed) 17:59:50

0

phyfsw

256

Relation between Bloch spectral function and DOS

Last Post : August 08, 2007 (Wed) 14:02:31

4

Masahiro Tanaka

254

execution problem with spc calculation

Last Post : July 31, 2007 (Tue) 22:05:46

1

bhihi

253

how to calculate the energy of the disordered local moment for the doped system

Last Post : July 17, 2007 (Tue) 21:45:24

0

phyfsw

250

Please response the questions on the BBS Board

Last Post : July 16, 2007 (Mon) 10:31:43

0

phyfsw

249

On lattice constant calculation

Last Post : July 16, 2007 (Mon) 10:42:46

1

Masahiro Tanaka