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- LHFCALC
- LHYPERFINE
- LIBMBD ALPHA
- LIBMBD C6AU
- LIBMBD K GRID
- LIBMBD K GRID SHIFT
- LIBMBD MBD A
- LIBMBD MBD BETA
- LIBMBD METHOD
- LIBMBD N OMEGA GRID
- LIBMBD PARALLEL MODE
- LIBMBD R0AU
- LIBMBD TS D
- LIBMBD TS SR
- LIBMBD VDW PARAMS KIND
- LIBMBD XC
- LIBXC1
- LIBXC1 Pn
- LIBXC2
- LIBXC2 Pn
- LKPOINTS OPT
- LKPOINTS WAN
- LKPROJ
- LLRAUG
- LMAXFOCK
- LMAXMIX
- LMAXPAW
- LMAXTAU
- LMIXTAU
- LMODELHF
- LMONO
- LMP2LT
- LNABLA
- LNMR SYM RED
- LNONCOLLINEAR
- LOCPOT
- LOCPROJ
- LOPTICS
- LORBIT
- LORBITALREAL
- LORBMOM
- LPARD
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- LPHON DISPERSION
- LPHON POLAR
- LPHON READ FORCE CONSTANTS
- LPLANE
- LREAL
- LRHFCALC
- LRPA
- LRPAFORCE
- LSCAAWARE
- LSCALAPACK
- LSCALER0
- LSCALU
- LSCDM
- LSCK
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- LSELFENERGY
- LSEPB
- LSEPK
- LSINGLES
- LSMP2LT
- LSORBIT
- LSPECTRAL
- LSPECTRALGW
- LSPIN VDW
- LSPIRAL
- LSUBROT
- LTBOUNDLIBXC
- LTEMPER
- LTHOMAS
- LTMP2 - Tutorial
- LTRIPLET
- LTSSURF
- LUSENCCL
- LUSE VDW
- LVACPOTAV
- LVDWEXPANSION
- LVDWSCS
- LVDW EWALD
- LVDW ONECELL
- LVGVAPPL
- LVGVCALC
- LVHAR
- LVTOT
- LWANNIER90
- LWANNIER90 RUN
- LWAVE
- LWAVEH5
- LWEIGHTED
- LWRITE MMN AMN
- LWRITE SPN
- LWRITE UNK
- LWRITE WANPROJ
- LZEROZ
- Langevin thermostat
- Lattice Dynamics - Tutorial
- Lectures and presentations
- Linking to libraries
- Liquid Si - Freezing
- Liquid Si - MLFF
- Liquid Si - Standard MD
- List of hybrid functionals
- Low-scaling GW: The space-time formalism
- MAGMOM
- MAXMEM
- MAXMIX
- MDALGO
- METAGGA
- MINROT
- MIXPRE
- ML AB
- ML ABN
- ML AFILT2
- ML CDOUB
- ML CSIG
- ML CSLOPE
- ML CTIFOR
- ML CX
- ML DESC TYPE
- ML EATOM
- ML EATOM REF
- ML EPS LOW
- ML EPS REG
- ML FF
- ML FFN
- ML HEAT
- ML HIS
- ML IAFILT2
- ML IALGO LINREG
- ML ICOUPLE
- ML ICRITERIA
- ML IERR
- ML IREG
- ML ISCALE TOTEN
- ML ISTART
- ML IWEIGHT
- ML LAFILT2
- ML LBASIS DISCARD
- ML LCOUPLE
- ML LEATOM
- ML LERR
- ML LFAST
- ML LHEAT
- ML LMAX2
- ML LMLFF
- ML LOGFILE
- ML LSPARSDES
- ML LUSE NAMES
- ML MB
- ML MB MIN
- ML MCONF
- ML MCONF NEW
- ML MHIS
- ML MODE
- ML MRB1
- ML MRB2
- ML NATOM COUPLED
- ML NHYP
- ML NMDINT
- ML NRANK SPARSDES
- ML OUTBLOCK
- ML OUTPUT MODE
- ML RCOUPLE
- ML RCUT1
- ML RCUT2
- ML RDES SPARSDES
- ML REG
- ML SCLC CTIFOR
- ML SIGV0
- ML SIGW0
- ML SION1
- ML SION2
- ML W1
- ML WTIFOR
- ML WTOTEN
- ML WTSIF
- MP2
- MP2 calculations
- MP2 ground state calculation - Tutorial
- M CONSTR
- Machine learning force field: Theory
- Machine learning force field - Tutorial
- Machine learning force field calculations: Basics
- Magnetism - Tutorial
- Main Page
- Makefile.include
- Makefile.include.aocc ompi aocl
- Makefile.include.aocc ompi aocl omp
- Makefile.include.fujitsu a64fx
- Makefile.include.fujitsu a64fx omp
- Makefile.include.gnu
- Makefile.include.gnu omp
- Makefile.include.gnu ompi aocl
- Makefile.include.gnu ompi aocl omp
- Makefile.include.gnu ompi mkl omp
- Makefile.include.intel
- Makefile.include.intel omp
- Makefile.include.intel ompi mkl omp
- Makefile.include.intel serial
- Makefile.include.linux gfortran
- Makefile.include.linux intel
- Makefile.include.linux intel cuda
- Makefile.include.nec aurora
- Makefile.include.nvhpc
- Makefile.include.nvhpc acc
- Makefile.include.nvhpc omp
- Makefile.include.nvhpc omp acc
- Makefile.include.nvhpc ompi mkl omp
- Makefile.include.nvhpc ompi mkl omp acc
- Makefile.include.oneapi
- Makefile.include.oneapi omp
- Many-body dispersion energy
- Many-body dispersion energy with fractionally ionic model for polarizability
- Matsubara formalism
- Memory requirements
- Metadynamics
- Metadynamics calculations
- MgO optimum mixing
- Minimal reproducible example
- Molecular dynamics - Tutorial
- Molecular dynamics calculations
- NATURALO
- NBANDS
- NBANDSEXACT
- NBANDSGW
- NBANDSO
- NBANDSV
- NBANDS WAVE
- NBLK
- NBLOCK
- NBMOD
- NBSEEIG
- NCORE
- NCORES PER BAND
- NCORE IN IMAGE1
- NCRPA BANDS
- NCSHMEM
- NEDOS
- NELECT
- NELM
- NELMDL
- NELMGW
- NELMIN
- NERSC Berkeley 2016
- NERSC Berkeley 2016 HOWTO
- NFREE
- NGX
- NGXF
- NGY
- NGYF
- NGYROMAG
- NGZ
- NGZF
- NHC NCHAINS
- NHC NRESPA
- NHC NS
- NHC PERIOD
- NKRED
- NKREDX
- NKREDY
- NKREDZ
- NLSPLINE
- NMAXFOCKAE and LMAXFOCKAE
- NOMEGA
- NOMEGAPAR
- NOMEGAR
- NOMEGA DUMP
- NPACO
- NPAR
- NPPSTR
- NRMM
- NSIM
- NSTORB
- NSUBSYS
- NSW
- NTARGET STATES
- NTAUPAR
- NTEMPER
- NUM WANN
- NUPDOWN
- NVE ensemble
- NVT ensemble
- NWRITE
- NiO
- NiO GGA
- NiO GGA+U
- NiO HSE06
- NiO LSDA+U
- Ni 100 surface DOS
- Ni 100 surface bandstructure
- Ni 100 surface relaxation
- Ni 111 surface high precision
- Ni 111 surface relaxation
- Nonlocal vdW-DF functionals
- Nose-Hoover-chain thermostat
- Nose-Hoover thermostat
- Not enough memory
- NpH ensemble
- NpT ensemble
- Nucleophile Substitution CH3Cl - Standard MD
- Nuclephile Substitution CH3Cl - BM
- Nuclephile Substitution CH3Cl - SG
- Nuclephile Substitution CH3Cl - mMD1
- Nuclephile Substitution CH3Cl - mMD2
- Nuclephile Substitution CH3Cl - mMD3
- Nudged elastic bands
- Number of G-vectors changed in the star
- Number of bands NBANDS
- Number of k points and method for smearing
- ODDONLY
- ODDONLYGW
- OFIELD A
- OFIELD KAPPA
- OFIELD Q6 FAR
- OFIELD Q6 NEAR
- OMEGAMAX
- OMEGAMIN
- OMEGATL
- OSZICAR
- OUTCAR
- O atom
- O atom spinpolarized
- O atom spinpolarized low symmetry
- O dimer
- Ompi+omp.conf
- OpenACC GPU port of VASP
- Optical properties and dielectric response - Tutorial
- Optimizing the parallelization
- Output
- PARAM1
- PARAM2
- PARCHG
- PAW control tags
- PCDAT
- PENALTYPOT
- PFLAT
- PHON BORN CHARGES
- PHON DIELECTRIC
- PHON DOS
- PHON G CUTOFF
- PHON LBOSE
- PHON LMC
- PHON NEDOS