Home
last modified time | relevance | path

Searched refs:e2file (Results 1 – 20 of 20) sorted by relevance

/dports/science/openkim-models/openkim-models-2021-01-28/model-drivers/SNAP__MD_536750310735_000/
H A DTABLE.cpp196 e2file = std::move(other.e2file); in TABLE()
231 e2file = std::move(other.e2file); in operator =()
600 e[i] = splint(rfile, efile, e2file, ninput, r); in compute_table()
634 e[i] = splint(rfile, efile, e2file, ninput, r); in compute_table()
678 e[i] = splint(rfile, efile, e2file, ninput, r); in compute_table()
788 e[i] = splint(rfile, efile, e2file, ninput, r); in compute_table()
857 double const e_tmp = splint(rfile, efile, e2file, ninput, r); in compute_table()
876 e2file.resize(ninput); in spline_table()
882 spline(rfile, efile, ninput, ep0, epn, e2file); in spline_table()
H A DTABLE.hpp280 std::vector<double> e2file; member in TABLE
/dports/science/lammps/lammps-stable_29Sep2021/src/DPD-REACT/
H A Dfix_eos_table.cpp172 tb->e2file = nullptr; in null_table()
183 memory->destroy(tb->e2file); in free_table()
253 memory->create(tb->e2file,tb->ninput,"eos:e2file"); in spline_table()
257 spline(tb->rfile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
287 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,a); in compute_table()
H A Dfix_eos_table.h46 double *e2file; member
H A Dfix_eos_table_rx.h47 double *e2file; member
H A Dpair_multi_lucy.h57 double *e2file, *f2file; member
H A Dpair_multi_lucy.cpp450 memory->create(tb->e2file,tb->ninput,"pair:e2file"); in spline_table()
455 spline(tb->rfile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
542 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,r); in compute_table()
571 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,r); in compute_table()
590 tb->e2file = tb->f2file = nullptr; in null_table()
604 memory->destroy(tb->e2file); in free_table()
H A Dpair_multi_lucy_rx.h57 double *e2file, *f2file; member
H A Dfix_eos_table_rx.cpp392 tb->e2file = nullptr; in null_table()
403 memory->destroy(tb->e2file); in free_table()
514 memory->create(tb->e2file,tb->ninput,"eos:e2file"); in spline_table()
518 spline(tb->rfile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
549 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,a); in compute_table()
H A Dpair_multi_lucy_rx.cpp590 memory->create(tb->e2file,tb->ninput,"pair:e2file"); in spline_table()
595 spline(tb->rfile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
682 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,r); in compute_table()
711 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,r); in compute_table()
730 tb->e2file = tb->f2file = nullptr; in null_table()
744 memory->destroy(tb->e2file); in free_table()
/dports/science/lammps/lammps-stable_29Sep2021/src/MOLECULE/
H A Dbond_table.cpp281 tb->e2file = tb->f2file = nullptr; in null_table()
293 memory->destroy(tb->e2file); in free_table()
399 memory->create(tb->e2file,tb->ninput,"bond:e2file"); in spline_table()
404 spline(tb->rfile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
448 tb->e[i] = splint(tb->rfile,tb->efile,tb->e2file,tb->ninput,a); in compute_table()
H A Dbond_table.h50 double *e2file, *f2file; member
H A Dangle_table.h49 double *e2file, *f2file; member
H A Dangle_table.cpp356 tb->e2file = tb->f2file = nullptr; in null_table()
368 memory->destroy(tb->e2file); in free_table()
435 memory->create(tb->e2file,tb->ninput,"angle:e2file"); in spline_table()
440 spline(tb->afile,tb->efile,tb->ninput,ep0,epn,tb->e2file); in spline_table()
483 tb->e[i] = splint(tb->afile,tb->efile,tb->e2file,tb->ninput,a); in compute_table()
H A Ddihedral_table.cpp991 tb->e2file = tb->f2file = nullptr; in null_table()
1003 memory->destroy(tb->e2file); in free_table()
1067 memory->create(tb->e2file,tb->ninput,"dihedral:e2file"); in spline_table()
1071 MY_2PI,tb->e2file,comm->me == 0)) in spline_table()
1183 tb->e[i]= cyc_splint(tb->phifile,tb->efile,tb->e2file,tb->ninput,MY_2PI,phi); in compute_table()
H A Ddihedral_table.h53 double *e2file, *f2file; member
/dports/science/lammps/lammps-stable_29Sep2021/src/
H A Dpair_table.cpp528 memory->create(tb->e2file, tb->ninput, "pair:e2file"); in spline_table()
533 spline(tb->rfile, tb->efile, tb->ninput, ep0, epn, tb->e2file); in spline_table()
625 tb->e[i] = splint(tb->rfile, tb->efile, tb->e2file, tb->ninput, r); in compute_table()
654 tb->e[i] = splint(tb->rfile, tb->efile, tb->e2file, tb->ninput, r); in compute_table()
691 tb->e[i] = splint(tb->rfile, tb->efile, tb->e2file, tb->ninput, r); in compute_table()
776 tb->e[i] = splint(tb->rfile, tb->efile, tb->e2file, tb->ninput, r); in compute_table()
824 e_tmp = splint(tb->rfile, tb->efile, tb->e2file, tb->ninput, r); in compute_table()
841 tb->e2file = tb->f2file = nullptr; in null_table()
855 memory->destroy(tb->e2file); in free_table()
H A Dpair_table.h52 double *e2file, *f2file; member
/dports/devel/ftnchek/ftnchek-3.3.1/test/
H A Dt208x.f39 character*18 e1file,e2file,e3file,e4file,e5file
/dports/devel/ftnchek/ftnchek-3.3.1/test/Okay/
H A Dt208x.dc539 CHARACTER*18 e24file, e2file, e3file, e4file