Loading doc/src/lammps.book +1 −0 Original line number Diff line number Diff line Loading @@ -497,6 +497,7 @@ pair_yukawa.html pair_yukawa_colloid.html pair_zbl.html pair_zero.html pair_zhou.html bond_class2.html bond_fene.html Loading doc/src/pair_zhou.txt +10 −2 Original line number Diff line number Diff line Loading @@ -28,7 +28,7 @@ pair_coeff 1 2 zhou 0.0 1.0 1.0 10.2847 2.361 :pre Style {zhou} computes pairwise van der Waals (vdW) interactions using the "(Grimme)"_#Grimme method implemented in the Many-Body Metal-Organic (MOMB) force field described extensively in "(Fichthorn)"_#Fichthorn and "(Zhou)"_#Zhou. This potential is widely used to correct for dispersion "(Zhou)"_#Zhou4. This potential is widely used to correct for dispersion in density functional theory calculations. :c,image(Eqs/pair_zhou.jpg) Loading @@ -46,11 +46,19 @@ Rr (distance units) :ul :line [Restrictions:] This style is part of the USER-MISC package. It is only enabled if LAMMPS is build with that package. See the "Making of LAMMPS"_Section_start.html#start_3 section for more info. [Related commands:] :link(Grimme) [(Grimme)] Grimme, J Comput Chem, 27(15), 1787-1799 (2006). :link(Fichthorn) [(Fichthorn)] Fichthorn, Balankura, Qi, CrystEngComm, 18(29), 5410-5417 (2016). :link(Zhou) :link(Zhou4) [(Zhou)] Zhou, Saidi, Fichthorn, J Phys Chem C, 118(6), 3366-3374 (2014). src/.gitignore +2 −0 Original line number Diff line number Diff line Loading @@ -815,6 +815,8 @@ /pair_tri_lj.h /pair_yukawa_colloid.cpp /pair_yukawa_colloid.h /pair_zhou.cpp /pair_zhou.h /pppm.cpp /pppm.h /pppm_cg.cpp Loading Loading
doc/src/lammps.book +1 −0 Original line number Diff line number Diff line Loading @@ -497,6 +497,7 @@ pair_yukawa.html pair_yukawa_colloid.html pair_zbl.html pair_zero.html pair_zhou.html bond_class2.html bond_fene.html Loading
doc/src/pair_zhou.txt +10 −2 Original line number Diff line number Diff line Loading @@ -28,7 +28,7 @@ pair_coeff 1 2 zhou 0.0 1.0 1.0 10.2847 2.361 :pre Style {zhou} computes pairwise van der Waals (vdW) interactions using the "(Grimme)"_#Grimme method implemented in the Many-Body Metal-Organic (MOMB) force field described extensively in "(Fichthorn)"_#Fichthorn and "(Zhou)"_#Zhou. This potential is widely used to correct for dispersion "(Zhou)"_#Zhou4. This potential is widely used to correct for dispersion in density functional theory calculations. :c,image(Eqs/pair_zhou.jpg) Loading @@ -46,11 +46,19 @@ Rr (distance units) :ul :line [Restrictions:] This style is part of the USER-MISC package. It is only enabled if LAMMPS is build with that package. See the "Making of LAMMPS"_Section_start.html#start_3 section for more info. [Related commands:] :link(Grimme) [(Grimme)] Grimme, J Comput Chem, 27(15), 1787-1799 (2006). :link(Fichthorn) [(Fichthorn)] Fichthorn, Balankura, Qi, CrystEngComm, 18(29), 5410-5417 (2016). :link(Zhou) :link(Zhou4) [(Zhou)] Zhou, Saidi, Fichthorn, J Phys Chem C, 118(6), 3366-3374 (2014).
src/.gitignore +2 −0 Original line number Diff line number Diff line Loading @@ -815,6 +815,8 @@ /pair_tri_lj.h /pair_yukawa_colloid.cpp /pair_yukawa_colloid.h /pair_zhou.cpp /pair_zhou.h /pppm.cpp /pppm.h /pppm_cg.cpp Loading
