Searched refs:jIntfCoup2 (Results 1 – 1 of 1) sorted by relevance
| /dports/science/lammps/lammps-stable_29Sep2021/src/SMTBQ/ |
| H A D | pair_smtbq.cpp | 1536 double engBB,fforceBB, dIntfcoup2loc,iCoord,jCoord,iIntfCoup2,jIntfCoup2; in potqeq() local
1553 jIntfCoup2= Intfcoup2(jCoord,coordOxBulk,0.15); in potqeq()
1587 + (iIntfCoup2+jIntfCoup2)*((engBulk-engSurf)/(2*(coordOxBulk-coordOxSurf)) in potqeq()
1603 + (iIntfCoup2+jIntfCoup2)*((fforceBulk-fforceSurf)/(2*(coordOxBulk-coordOxSurf)) in potqeq()
1616 { iIntfCoup2=jIntfCoup2; in potqeq()
1664 double engBB,iCoord,jCoord,iIntfCoup2,jIntfCoup2; in pot_ES() local
1681 jIntfCoup2= Intfcoup2(jCoord,coordOxBulk,0.15); in pot_ES()
1706 + (iIntfCoup2+jIntfCoup2)*((engBulk-engSurf)/(2*(coordOxBulk-coordOxSurf)) in pot_ES()
1720 iIntfCoup2=jIntfCoup2; in pot_ES()
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