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teqp 0.23.1
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Classes | |
| class | DipolarContributionGrossVrabec |
| class | DipolarQuadrupolarContributionVrabecGross |
| class | MultipolarContributionGrossVrabec |
| struct | MultipolarContributionGrossVrabecTerms |
| class | QuadrupolarContributionGross |
Functions | |
| template<typename Eta, typename MType, typename TType> | |
| auto | get_JDD_2ij (const Eta &eta, const MType &mij, const TType &Tstarij) |
| Eq. 10 from Gross and Vrabec. | |
| template<typename Eta, typename MType> | |
| auto | get_JDD_3ijk (const Eta &eta, const MType &mijk) |
| Eq. 11 from Gross and Vrabec. | |
| template<typename Eta, typename MType, typename TType> | |
| auto | get_JQQ_2ij (const Eta &eta, const MType &mij, const TType &Tstarij) |
| Eq. 12 from Gross and Vrabec, AICHEJ. | |
| template<typename Eta, typename MType> | |
| auto | get_JQQ_3ijk (const Eta &eta, const MType &mijk) |
| Eq. 13 from Gross and Vrabec, AICHEJ. | |
| template<typename Eta, typename MType, typename TType> | |
| auto | get_JDQ_2ij (const Eta &eta, const MType &mij, const TType &Tstarij) |
| Eq. 16 from Vrabec and Gross, JPCB, 2008. doi: 10.1021/jp072619u. | |
| template<typename Eta, typename MType> | |
| auto | get_JDQ_3ijk (const Eta &eta, const MType &mijk) |
| Eq. 17 from Vrabec and Gross, JPCB, 2008. doi: 10.1021/jp072619u. | |
| auto teqp::saft::polar_terms::GrossVrabec::get_JDD_2ij | ( | const Eta & | eta, |
| const MType & | mij, | ||
| const TType & | Tstarij ) |
Eq. 10 from Gross and Vrabec.
Definition at line 9 of file GrossVrabec.hpp.
| auto teqp::saft::polar_terms::GrossVrabec::get_JDD_3ijk | ( | const Eta & | eta, |
| const MType & | mijk ) |
Eq. 11 from Gross and Vrabec.
Definition at line 29 of file GrossVrabec.hpp.
| auto teqp::saft::polar_terms::GrossVrabec::get_JDQ_2ij | ( | const Eta & | eta, |
| const MType & | mij, | ||
| const TType & | Tstarij ) |
Eq. 16 from Vrabec and Gross, JPCB, 2008. doi: 10.1021/jp072619u.
Definition at line 78 of file GrossVrabec.hpp.
| auto teqp::saft::polar_terms::GrossVrabec::get_JDQ_3ijk | ( | const Eta & | eta, |
| const MType & | mijk ) |
Eq. 17 from Vrabec and Gross, JPCB, 2008. doi: 10.1021/jp072619u.
Definition at line 99 of file GrossVrabec.hpp.
| auto teqp::saft::polar_terms::GrossVrabec::get_JQQ_2ij | ( | const Eta & | eta, |
| const MType & | mij, | ||
| const TType & | Tstarij ) |
Eq. 12 from Gross and Vrabec, AICHEJ.
Definition at line 43 of file GrossVrabec.hpp.
| auto teqp::saft::polar_terms::GrossVrabec::get_JQQ_3ijk | ( | const Eta & | eta, |
| const MType & | mijk ) |
Eq. 13 from Gross and Vrabec, AICHEJ.
Definition at line 63 of file GrossVrabec.hpp.