/dports/science/quantum-espresso/q-e-qe-6.7.0/PW/tools/ |
H A D | pwi2xsf.f90 | 466 subroutine read_atoms(nat,atm,coor) subroutine 471 & nat, &! number of atoms 472 & ipol,inat,len, &! counters 473 & string_length ! integer-function 475 & line*120 ! line of input 477 & atm(*) ! atomic symbols 479 & coor(3,*) 482 10 continue
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/dports/science/py-gpaw/gpaw-21.6.0/gpaw/io/ |
H A D | old.py | 234 def read_atoms(reader): function
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/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/ |
H A D | reader_xyz.cpp | 194 void ReaderXYZ::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderXYZ
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H A D | reader_native.cpp | 345 void ReaderNative::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderNative
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/dports/science/lammps/lammps-stable_29Sep2021/src/ |
H A D | reader_xyz.cpp | 169 void ReaderXYZ::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderXYZ
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H A D | reader_native.cpp | 312 void ReaderNative::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderNative
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H A D | read_dump.cpp | 689 void ReadDump::read_atoms() in read_atoms() function in ReadDump
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/dports/science/lammps/lammps-stable_29Sep2021/src/MOLFILE/ |
H A D | reader_molfile.cpp | 331 void ReaderMolfile::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderMolfile
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/dports/x11-wm/openbox/openbox-3.6/tools/obxprop/ |
H A D | obxprop.c | 167 gchar* read_atoms(Display *d, guchar *val, guint n) in read_atoms() function
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/dports/science/lammps/lammps-stable_29Sep2021/src/ADIOS/ |
H A D | reader_adios.cpp | 476 void ReaderADIOS::read_atoms(int n, int nfield, double **fields) in read_atoms() function in ReaderADIOS
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/dports/science/py-ase/ase-3.22.0/ase/io/ |
H A D | trajectory.py | 335 def read_atoms(backend, function
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/dports/science/gromacs/gromacs-2021.4/src/gromacs/gmxpreprocess/ |
H A D | resall.cpp | 126 static bool read_atoms(FILE* in, char* line, PreprocessResidue* r0, t_symtab* tab, PreprocessingAto… in read_atoms() function
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/dports/science/qwalk/mainline-1.0.1-300-g1b7e381/src/converter/ |
H A D | nwchem2qmc.cpp | 239 int read_atoms=0; in read_nwchem_out() local
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H A D | siesta2qmc.cpp | 476 void read_atoms(istream & is, vector <string> & currline, in read_atoms() function
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/dports/science/py-ase/ase-3.22.0/ase/calculators/ |
H A D | calculator.py | 668 def read_atoms(cls, restart, **kwargs): member in Calculator
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/dports/science/py-ase/ase-3.22.0/ase/calculators/vasp/ |
H A D | vasp.py | 530 def read_atoms(self, filename): member in Vasp
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