Manual for mVMCΒΆ
- What is mVMC?
- How to use mVMC?
- Tutorial
- Input files for Standard mode
- Input files for Expert mode
- List file for Input files (namelist.def)
- ModPara file (modpara.def)
- LocSpin file (locspn.def)
- Trans file (trans.def)
- InterAll file
- CoulombIntra file (coulombintra.def)
- CoulombInter file (coulombinter.def)
- Hund file (hund.def)
- PairHop file
- Exchange file (exchange.def)
- Gutzwiller file (gutzwiller.def)
- Jastrow file (jastrow.def)
- DH2 file
- DH4 file
- Orbital/OrbitalAntiParallel file (orbitalidx.def)
- OrbitalParallel file
- OrbitalGeneral file
- TransSym file (qptransidx.def)
- Files to set initial values of variational parameters
- OneBodyG file (greenone.def)
- TwoBodyG file (greentwo.def)
- Output files
- Output file for variational parameters (***_opt.dat)
- Output files for variational parameters at each step (xxx_var_yyy.dat)
- Output file for gutzwiller factors (***_gutzwiller_opt.dat)
- Output file for jastrow factors (***_jastrow_opt.dat)
- Output file for doublonHolon 2-site factors (***_doublonHolon2site_opt.dat)
- Output file for doublonHolon 4-site factors (***_doublonHolon4site_opt.dat)
- Output file for pair orbitals (***_orbital_opt.dat)
- xxx_out_yyy.dat
- xxx_CalcTimer.dat
- xxx_time_zzz.dat
- xxx_cisajs_yyy.dat
- xxx_cisajscktalt_yyy.dat
- xxx_ls_out_yyy.dat
- xxx_ls_cisajs_yyy.dat
- xxx_ls_cisajscktalt_yyy.dat
- Algorithm
- Program for the unrestricted Hartree-Fock approximation
- HPhi/mVMC Fourier-Transformation utility
- Downfolding with Wannier functions
- Acknowledgement
