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Searched refs:qelectron (Results 1 – 12 of 12) sorted by relevance

/dports/science/liggghts/LIGGGHTS-PUBLIC-3.8.0-26-g6e873439/src/
H A Dupdate.cpp176 force->qelectron = 1.0; in set_units()
197 force->qelectron = 1.0; in set_units()
218 force->qelectron = 1.0; in set_units()
239 force->qelectron = 1.6021765e-19; in set_units()
260 force->qelectron = 4.8032044e-10; in set_units()
281 force->qelectron = 1.0; in set_units()
302 force->qelectron = 1.6021765e-19; in set_units()
323 force->qelectron = 1.6021765e-19; in set_units()
H A Dkspace.cpp95 (force->qelectron * force->qelectron) / in KSpace()
H A Dforce.h96 double qelectron; // 1 electron charge abs() in native units variable
/dports/science/lammps/lammps-stable_29Sep2021/src/
H A Dupdate.cpp150 force->qelectron = 1.0; in set_units()
171 force->qelectron = 1.0; in set_units()
192 force->qelectron = 1.0; in set_units()
213 force->qelectron = 1.6021765e-19; in set_units()
234 force->qelectron = 4.8032044e-10; in set_units()
255 force->qelectron = 1.0; in set_units()
276 force->qelectron = 1.6021765e-7; in set_units()
297 force->qelectron = 1.0; in set_units()
H A Dforce.h63 double qelectron; // 1 electron charge abs() in native units variable
H A Dkspace.cpp168 (force->qelectron * force->qelectron) / in two_charge()
H A Dpair_zbl.cpp496 zze[i][j] = zi*zj*force->qqr2e*force->qelectron*force->qelectron; in set_coeff()
H A Dlibrary.cpp1512 if (strcmp(name,"qelectron") == 0) return (void *) &lmp->force->qelectron; in lammps_extract_global()
/dports/science/openkim-models/openkim-models-2021-01-28/model-drivers/SNAP__MD_536750310735_000/
H A DZBL.cpp134 double const qelectron) in set_coeff() argument
143 zze(iSpecies, jSpecies) = z_iSpecies * z_jSpecies * qqr2e * qelectron * qelectron; in set_coeff()
H A DZBL.hpp133 double const qelectron);
H A DSNAPImplementation.hpp558 double qelectron; member in SNAPImplementation
H A DSNAPImplementation.cpp101 qelectron(1.0), in SNAPImplementation()
1595 qelectron *= convertCharge; in ConvertUnits()
1698 …ff(iSpecies, jSpecies, atomicNumber[iSpecies], atomicNumber[jSpecies], angstrom, qqr2e, qelectron); in setRefreshMutableValues()