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• [Wannier] Making changes in output hopping parameter and onsite energy Asif Ali 1810506
• [Wannier] MPI compilation issue on fedora wenusaras
• [Wannier] Error in postw90.x when calculate the complex optical conductivity ???????? ????
• [Wannier] [Wannier90] initial projections wenusaras
• [Wannier] error in wannier90.x 夏宇阳
• [Wannier] Wannier90 and GPU Bhargab Kakati
  • Re: [Wannier] Wannier90 and GPU Nicola Marzari
• [Wannier] Abinit interface to Wannier90 code for spinor wave functions Shima Sharifi (Tyndall)
  • Re: [Wannier] Abinit interface to Wannier90 code for spinor wave functions Giovanni Pizzi
• [Wannier] Regarding open_grid.x wenusaras
• [Wannier] Mismatch in bands path vs dft calculation Karkee, Rijan
• [Wannier] how to find out the projection used in SCDM method Bhargab Kakati
  • Re: [Wannier] how to find out the projection used in SCDM method Giovanni Pizzi
• [Wannier] Spin berry curvature for each spin separately Souren Adhikary
• [Wannier] Time taken for Wannier90 calculation Akhil g.nair
• [Wannier] Error in w90_wannier90_readwrite_read: mismatch Karkee, Rijan
• [Wannier] Is the berry curvature printed in Wannier gauge in postw90? Vahid Askarpour
• [Wannier] Postw90 and Berry curvature origin Vahid Askarpour
  • Re: [Wannier] Postw90 and Berry curvature origin David Vanderbilt
  • Re: [Wannier] Postw90 and Berry curvature origin Vahid Askarpour
• [Wannier] seg fault during wannier_setup call in library mode Jacopo Simoni
• [Wannier] kslice Matplotlib griddata error Vahid Askarpour
  • Re: [Wannier] kslice Matplotlib griddata error Bhargab Kakati
  • Re: [Wannier] kslice Matplotlib griddata error Vahid Askarpour
• [Wannier] Finding Berry curvature in BZ Vahid Askarpour
  • Re: [Wannier] Finding Berry curvature in BZ Stepan Tsirkin
  • Re: [Wannier] Finding Berry curvature in BZ Vahid Askarpour
• [Wannier] k-gradient implementation Lun Yue
  • Re: [Wannier] k-gradient implementation Nicola Marzari
  • Re: [Wannier] k-gradient implementation Jonathan Yates
  • Re: [Wannier] k-gradient implementation Lun Yue
  • Re: [Wannier] k-gradient implementation Junfeng Qiao
  • Re: [Wannier] k-gradient implementation Lun Yue
• [Wannier] Density matrix in Wannier basis Jacopo Simoni
• [Wannier] Help with spin up down band structure with spin orbit coupling Malcolm Jardine
• [Wannier] Query about wannier90 calculations on disordered supercell Mouyang Cheng
  • Re: [Wannier] Query about wannier90 calculations on disordered supercell Stepan Tsirkin
  • Re: [Wannier] 回复: Query about wannier90 calculations on disordered supercell Stepan Tsirkin
  • Re: [Wannier] 回复: Query about wannier90 calculations on disordered supercell Mouyang Cheng
  • Re: [Wannier] 回复: Query about wannier90 calculations on disordered supercell Nicola Marzari
• [Wannier] VASP + wannier90 interface unenable to exclude bands for the calculation Ajay Partap Singh Rana
• [Wannier] choice of kslice vectors in the BZ in example-18 of wannier90 Bhargab Kakati
• [Wannier] Spin Down Channel Trapped in Local Minimum Patrick Taylor
• [Wannier] Trouble getting symmetry adapted Wannier functions to converge Sink, Joe R
• Re: [Wannier] Trouble with kmesh/ bvectors Jonathan Yates
• [Wannier] Can we calculate Topological Hall Effect (THE) in wannier90? Bhargab Kakati
• [Wannier] gamma_only= true - wannier90.mmn has not the right number of nearest neighbours Mohammad Sadegh Talezadehlari
• [Wannier] [SPAM] postw90.x gets stucked while reading Distance to Nearest-Neighbour Shells Bhargab Kakati
• [Wannier] comparing QE and Wannier bands Adam Michalchuk
• [Wannier] [SPAM] significant discrepancy in wannier90 interpolated band structure and DFT band structure Bhargab Kakati
• [Wannier] discrepancy in wannier90 interpolated bandstructure and DFT bandstructure Bhargab Kakati
• [Wannier] Output abnormally 庞瑞
• [Wannier] executing wannier90.x in parallel: Program received signal SIGSEGV: Segmentation fault - invalid memory reference. Simon Imanuel Rombauer
• [Wannier] Overlap matrix between wannier function Dongkyu Lee
• [Wannier] Hermiticity of Berry potential matrix Lun Yue
  • Re: [Wannier] Hermiticity of Berry potential matrix David Vanderbilt
  • Re: [Wannier] Hermiticity of Berry potential matrix Lun Yue
• [Wannier] No seedname_u.mat output + segmentation fault Payden Brown
  • Re: [Wannier] No seedname_u.mat output + segmentation fault Payden Brown
• [Wannier] Wannier Developer Meeting Jerome Jackson
• [Wannier] wannier90.amn has not the right number of projections Mohammad Sadegh Talezadehlari
  • Re: [Wannier] wannier90.amn has not the right number of projections Mostofi, Arash
• [Wannier] error reading the .snn file Elio Physics
• [Wannier] help ilhan.yavuz
• [Wannier] Mismatch in kpt_latt vs. Non-symmetric k-point neighbour Vahid Askarpour
  • Re: [Wannier] Mismatch in kpt_latt vs. Non-symmetric k-point neighbour Vahid Askarpour
• Re: [Wannier] Direct Lattice Mismatch 아리담싼니얼
• [Wannier] hamiltonian_wigner_seitz: error zhouchao
• [Wannier] SCDM-k method and centering of WFs Marco Marino
  • Re: [Wannier] SCDM-k method and centering of WFs Giovanni Pizzi
• [Wannier] Berry connection. Thi Xuan Diem Dang
• [Wannier] Wannier functions on the IBZ Monteiro Campos de Melo, P.M. (Pedro)
• [Wannier] Fermi velocity calculation Surasree Sadhukhan
• [Wannier] Wannier90 Post Processing with VASP Francis Coen
• [Wannier] SHC calculation issue Park, In Jun
• [Wannier] Problem regarding Wannier90 Disentanglement Surasree Sadhukhan
• [Wannier] testing problem during installation of software Jingjing Yu
• Re: [Wannier] Mismatch in BoltzTrap and Boltzwann results Rakshanda Dhawan
• [Wannier] Fwd: Mismatch in BoltzTrap and Boltzwann results Rakshanda Dhawan
• [Wannier] Nb Phonon and Electron Band oscillatory Wannier Interpolation Bander Linjawi
• [Wannier] Question: Hermition Issue [ wannier90_r.dat ] Iryan Na
• [Wannier] symmetry adapted wannier function for MoS2 dd
• [Wannier] Discrepancy between Wannier90 and DFT band structures Azin Kazemi Moridani
  • Re: [Wannier] Discrepancy between Wannier90 and DFT band structures Jonathan Yates
  • Re: [Wannier] Discrepancy between Wannier90 and DFT band structures Azin Kazemi Moridani
• [Wannier] About use of local axis Shishir Pandey
• [Wannier] Negative value of mu during SCDM method ? saramoh
• [Wannier] overlap and KS Ham matrix in MLWF basis Li Wei
• [Wannier] Compiling wannier90 on macosx with arm64 architecture Maksim Borovkov
  • Re: [Wannier] Compiling wannier90 on macosx with arm64 architecture Jerome Jackson - STFC UKRI
  • Re: [Wannier] Compiling wannier90 on macosx with arm64 architecture Maksim Borovkov
  • Re: [Wannier] Compiling wannier90 on macosx with arm64 architecture Jerome Jackson - STFC UKRI
  • Re: [Wannier] Compiling wannier90 on macosx with arm64 architecture Maksim Borovkov
• [Wannier] connection elements Roozbeh Anvari
• [Wannier] From wien2wannier to postw90.x Marcelo Barbosa
• [Wannier] Wannier90 library developments Mostofi, Arash
  • Re: [Wannier] Wannier90 library developments Mostofi, Arash
• [Wannier] Issue with wannier90. SHC calculations SHUBHAM PATEL
• [Wannier] Berry Curvature Calculation with the Interface between Vasp and Wannier90 Kenan Song
• [Wannier] Request for clarification on the units of deleig Vahid Askarpour
• [Wannier] Postdoc position on the development and application of Wannier-function methods (San Sebastian, Spain) Stepan Tsirkin
• [Wannier] Wannier90_Gyrotropic Module_Unit of gamma in NOA Md Roknuzzaman
• [Wannier] Errors when using wannier90 interface with VASP 邱 国涛
  • Re: [Wannier] Errors when using wannier90 interface with VASP Jonathan Yates
• [Wannier] representing the xsf orbitals with a shift Fabrizio Cossu
• [Wannier] Projection onto spin-orbit coupled basis Karunya Shirali
• [Wannier] Query regarding Berry curvatures for conduction and valence bands Parrydeep Kaur
• [Wannier] [RE]Re: definition of zaxis Fabrizio Cossu
• [Wannier] Visualizing Wannier Functions in VESTA Alpin Novianus
• [Wannier] definition of zaxis Fabrizio Cossu
  • Re: [Wannier] definition of zaxis Mostofi, Arash
• [Wannier] On breaking the time-reversal symmetry of the Hamiltonian 氏家勇
• [Wannier] Symmetry-Adapted Wannier Functions with Spin-Orbit Interaction Shima Sharifi
• [Wannier] Unable to Disentangle Despite Correct Projections Truman Ng Yu
• [Wannier] Question: The matrix of tight-bounding parameters is not Hermitian Lithium
• [Wannier] Regarding 'surface card' for input card Debasish (P20PH019)
• [Wannier] Problems with the kslice module 氏家勇
• [Wannier] interband matrix elements of velocity operator in geninterp.f90 Sophie Beck
  • Re: [Wannier] interband matrix elements of velocity operator in geninterp.f90 Ivo Souza
• [Wannier] Calculation of kslice for example 17 氏家勇
• [Wannier] Use of shifted ab initio k-grids Stepan Tsirkin
  • [Wannier] Two posdoctoral openings - Wannier/Hubbard/Koopmans Nicola Marzari
• [Wannier] [Fwd: Projected Band structure] Mayuri Bora
• [Wannier] Question about the pseudopotential issue supported by wannier90 fang Opps
  • Re: [Wannier] Question about the pseudopotential issue supported by wannier90 Nicola Marzari
• [Wannier] Projected Band structure Mayuri Bora
• [Wannier] Queries regarding Berry curvature dipole Sayantika Bhowal
  • Re: [Wannier] Queries regarding Berry curvature dipole Stepan Tsirkin
• [Wannier] [SUSPECT ATTACHMENT REMOVED] SCDM error- No Gamma point found Roxana Morton
  • Re: [Wannier] [SUSPECT ATTACHMENT REMOVED] SCDM error- No Gamma point found Stepan Tsirkin
• [Wannier] Error 144, wrong number of kpoints Schön , Carl-Friedrich
  • Re: [Wannier] Error 144, wrong number of kpoints Alpin Novianus
  • Re: [Wannier] Error 144, wrong number of kpoints Schön , Carl-Friedrich
  • Re: [Wannier] Error 144, wrong number of kpoints Mostofi, Arash
• [Wannier] mailing list ETHEM AKTURK
• [Wannier] Different lattice parameters for wave functions using DFT and Wannier functions Payal Wadhwa
• [Wannier] Facing problem in calculating projected DOS using Wannier90 Payal Wadhwa
• Re: [Wannier] Problem in getting the wannier function in hexagonal BN mono layer. Stepan Tsirkin
• [Wannier] Available examples for antiferromagnetic system? Alpin Novianus
• [Wannier] Fermi Energy Shift in the Band Structure Truman Ng Yu
• [Wannier] parallel computing for plotting MLWFs Shima Sharifi
  • Re: [Wannier] parallel computing for plotting MLWFs Giovanni Pizzi
• [Wannier] How to convert the unit of spin Hall conductivity from "(hbar/e)*S/cm" to "e2/h"? Abid Rehman
  • Re: [Wannier] How to convert the unit of spin Hall conductivity from "(hbar/e)*S/cm" to "e2/h"? Junfeng Qiao
  • Re: [Wannier] How to convert the unit of spin Hall conductivity from "(hbar/e)*S/cm" to "e2/h"? Junfeng Qiao
• [Wannier] Wannier90 spin basis Iñigo Robredo
• Re: [Wannier] Error in Wannier90: kmesh_get: something wrong, found too many nearest neighbours Jonathan Yates
  • Re: [Wannier] Error in Wannier90: kmesh_get: something wrong, found too many nearest neighbours Soumyadeep
• [Wannier] error in wannier functions results for the specified projection orbitals 刘乐雨
• Re: [Wannier] Enquiry about the Failure in Wannierization Calculation Dominik Gresch
  • Re: [Wannier] Enquiry about the Failure in Wannierization Calculation Kenan Song
• [Wannier] Enquiry about the Failure in Wannierization Calculation Kenan Song
  • Re: [Wannier] Enquiry about the Failure in Wannierization Calculation Stepan Tsirkin
  • Re: [Wannier] Enquiry about the Failure in Wannierization Calculation Kenan Song
  • Re: [Wannier] Enquiry about the Failure in Wannierization Calculation hoangminh nguyenduy
  • Re: [Wannier] Enquiry about the Failure in Wannierization Calculation Kenan Song
• [Wannier] I have a question for postw90 dE/dk problem. 대학원 물리학과
• [Wannier] kmesh_get: something wrong, found too many nearest neighbours Hoang Minh Nguyen Duy
  • Re: [Wannier] kmesh_get: something wrong, found too many nearest neighbours Mostofi, Arash
• [Wannier] Bands color for Berry curvature calculations Sotiris Fragkos
• [Wannier] Vanderbilt and Resta online lectures - CECAM-MARVEL "Classics in molecular and materials modelling" Nicola Marzari
• [Wannier] How to resolve the issue "wannier90.uHu has not the right number of bands" which arise during the calculation of orbital magnetic moment using postwannier90? Abid Rehman
  • Re: [Wannier] How to resolve the issue "wannier90.uHu has not the right number of bands" which arise during the calculation of orbital magnetic moment using postwannier90? Stepan Tsirkin
• [Wannier] Deducing weight of the Wannier function. elchatz
  • Re: [Wannier] Deducing weight of the Wannier function. Stepan Tsirkin
  • Re: [Wannier] Deducing weight of the Wannier function. elchatz
• [Wannier] MPI version large systems Jonathan Backman
  • Re: [Wannier] MPI version large systems Jackson, Jerome (STFC,DL,SC)
  • Re: [Wannier] MPI version large systems Jonathan Backman
  • [Wannier] Fwd: MPI version large systems H. Lee
• [Wannier] TiO2 Iurii TIMROV
  • Re: [Wannier] TiO2 박민규
  • Re: [Wannier] TiO2 Iurii TIMROV
• [Wannier] What information can we see from viewing the MLWFNs by xcrysden? zhangkan3
• [Wannier] DOS and PDOS calculations zhangkan3
• [Wannier] [Symmetry-adapted Wannier functions] symmetrize_ukirr: not converged Ming Lei
• [Wannier] How to calculate the Berry curvature in 3D density-plot like view instead of 2D line curve Abid Rehman
  • Re: [Wannier] How to calculate the Berry curvature in 3D density-plot like view instead of 2D line curve Stepan Tsirkin
• [Wannier] Parallel Installation of postw90.x? Stephen Zhang
• [Wannier] error in pw2wannier90.x run Mahyar Servati
• [Wannier] Regarding internal error in k points in nscf calculations SOUMYAKANTA PANDA
• [Wannier] Issues with Reading Fortran Files in WannierBerri Stephen Zhang
• Re: [Wannier] Expanding wannier Hamiltonian of the unit cell to that of the supercell Dominik Gresch
• [Wannier] explicit supercell calculation Aaron M
• [Wannier] Questions about xsf output files (units, modifying grid density) and extracting wannier functions' charge distributions Wai-Ga Ho
  • Re: [Wannier] Questions about xsf output files (units, modifying grid density) and extracting wannier functions' charge distributions Mostofi, Arash
• [Wannier] Expanding wannier Hamiltonian of the unit cell to that of the supercell Kenan Song
  • Re: [Wannier] Expanding wannier Hamiltonian of the unit cell to that of the supercell Stepan Tsirkin
• Re: [Wannier] Inconsistency between DOS, Quantum conductance and Band structure Ankit Sirohi
  • Re: [Wannier] Inconsistency between DOS, Quantum conductance and Band structure Mostofi, Arash
• [Wannier] ZHEEV in internal_new_u_and_m failed 박민규
  • Re: [Wannier] ZHEEV in internal_new_u_and_m failed Giovanni Pizzi
  • Re: [Wannier] ZHEEV in internal_new_u_and_m failed 박민규
• [Wannier] How to write WF basis set as a combination of natural pure orbitals (s, p, d, etc.) Shima Sharifi
• [Wannier] Incorrect k path length Zeeshan Ahmad
  • Re: [Wannier] Incorrect k path length Christoph Wolf
• [Wannier] band gap of bilayer graphene Roozbeh Anvari
  • Re: [Wannier] band gap of bilayer graphene Roozbeh Anvari
• [Wannier] how to print out MLWF basis set Shima Sharifi
• [Wannier] Post90w.x Allocation Error? Stephen Zhang

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