#include <cosmo.h>
◆ COSMO()
occ::solvent::COSMO::COSMO |
( |
double |
dielectric, |
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double |
x = 0.0 |
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) |
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inline |
◆ dielectric()
double occ::solvent::COSMO::dielectric |
( |
| ) |
const |
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inline |
◆ operator()()
Result occ::solvent::COSMO::operator() |
( |
const Mat3N & |
, |
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const Vec & |
, |
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const Vec & |
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) |
| const |
◆ set_x()
void occ::solvent::COSMO::set_x |
( |
double |
x | ) |
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inline |
◆ surface_charge()
auto occ::solvent::COSMO::surface_charge |
( |
const Vec & |
charges | ) |
const |
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inline |
The documentation for this class was generated from the following file:
- /home/runner/work/occ/occ/include/occ/solvent/cosmo.h