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Searched refs:forces_bp_efield (Results 1 – 7 of 7) sorted by relevance

/dports/science/plumed/plumed2-2.7.2/patches/qespresso-5.0.2.diff/PW/src/
H A Dforces.f9061 forces_bp_efield(:,:), & local
172 ALLOCATE ( forces_bp_efield (3,nat) )
173 forces_bp_efield(:,:)=0.d0
175 if(okvan) call forces_us_efield(forces_bp_efield,gdir,efield)
176 call forces_ion_efield(forces_bp_efield,gdir,efield)
180 call forces_us_efield(forces_bp_efield,ipol,efield_cry(ipol))
184 call forces_ion_efield(forces_bp_efield,ipol,efield_cart(ipol))
207 IF (lelfield) force(ipol,na) = force(ipol,na) + forces_bp_efield(ipol,na)
349 IF ( lelfield ) DEALLOCATE ( forces_bp_efield )
H A Dforces.f90.preplumed61 forces_bp_efield(:,:), &
172 ALLOCATE ( forces_bp_efield (3,nat) )
173 forces_bp_efield(:,:)=0.d0
175 if(okvan) call forces_us_efield(forces_bp_efield,gdir,efield)
176 call forces_ion_efield(forces_bp_efield,gdir,efield)
180 call forces_us_efield(forces_bp_efield,ipol,efield_cry(ipol))
184 call forces_ion_efield(forces_bp_efield,ipol,efield_cart(ipol))
207 IF (lelfield) force(ipol,na) = force(ipol,na) + forces_bp_efield(ipol,na)
347 IF ( lelfield ) DEALLOCATE ( forces_bp_efield )
/dports/science/plumed/plumed2-2.7.2/patches/qespresso-6.2.diff/PW/src/
H A Dforces.f9072 forces_bp_efield(:,:), & local
180 ALLOCATE ( forces_bp_efield (3,nat) )
181 forces_bp_efield(:,:)=0.d0
183 if(okvan) call forces_us_efield(forces_bp_efield,gdir,efield)
184 call forces_ion_efield(forces_bp_efield,gdir,efield)
188 call forces_us_efield(forces_bp_efield,ipol,efield_cry(ipol))
192 call forces_ion_efield(forces_bp_efield,ipol,efield_cart(ipol))
221 IF (lelfield) force(ipol,na) = force(ipol,na) + forces_bp_efield(ipol,na)
406 IF ( lelfield ) DEALLOCATE ( forces_bp_efield )
H A Dforces.f90.preplumed72 forces_bp_efield(:,:), &
180 ALLOCATE ( forces_bp_efield (3,nat) )
181 forces_bp_efield(:,:)=0.d0
183 if(okvan) call forces_us_efield(forces_bp_efield,gdir,efield)
184 call forces_ion_efield(forces_bp_efield,gdir,efield)
188 call forces_us_efield(forces_bp_efield,ipol,efield_cry(ipol))
192 call forces_ion_efield(forces_bp_efield,ipol,efield_cart(ipol))
221 IF (lelfield) force(ipol,na) = force(ipol,na) + forces_bp_efield(ipol,na)
404 IF ( lelfield ) DEALLOCATE ( forces_bp_efield )
/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/src/
H A Dforces.f9070 forces_bp_efield(:,:),& local
177 ALLOCATE( forces_bp_efield(3,nat) )
178 forces_bp_efield(:,:) = 0.d0
180 IF (okvan) CALL forces_us_efield( forces_bp_efield, gdir, efield )
181 CALL forces_ion_efield( forces_bp_efield, gdir, efield )
185 CALL forces_us_efield( forces_bp_efield, ipol, efield_cry(ipol) )
189 CALL forces_ion_efield( forces_bp_efield, ipol, efield_cart(ipol) )
218 IF (lelfield) force(ipol,na) = force(ipol,na) + forces_bp_efield(ipol,na)
401 IF ( lelfield ) DEALLOCATE( forces_bp_efield )
H A Dmake.depend680 forces_bp_efield.o : ../../Modules/becmod.o
683 forces_bp_efield.o : ../../Modules/fft_base.o
684 forces_bp_efield.o : ../../Modules/io_files.o
687 forces_bp_efield.o : ../../Modules/kind.o
690 forces_bp_efield.o : ../../Modules/noncol.o
691 forces_bp_efield.o : ../../Modules/recvec.o
694 forces_bp_efield.o : ../../UtilXlib/mp.o
696 forces_bp_efield.o : ../../upflib/uspp.o
697 forces_bp_efield.o : bp_mod.o
698 forces_bp_efield.o : buffers.o
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H A DMakefile80 forces_bp_efield.o \