Loading doc/src/Commands_pair.txt +1 −0 Original line number Diff line number Diff line Loading @@ -80,6 +80,7 @@ OPT. "dpd/fdt/energy (k)"_pair_dpd_fdt.html, "dpd/tstat (go)"_pair_dpd.html, "dsmc"_pair_dsmc.html, "drip"_pair_drip.html, "eam (gikot)"_pair_eam.html, "eam/alloy (gikot)"_pair_eam.html, "eam/cd (o)"_pair_eam.html, Loading doc/src/lammps.book +1 −0 Original line number Diff line number Diff line Loading @@ -572,6 +572,7 @@ pair_dipole.html pair_dpd.html pair_dpd_fdt.html pair_dsmc.html pair_drip.html pair_eam.html pair_edip.html pair_eff.html Loading doc/src/pair_ilp_graphene_hbn.txt +4 −3 Original line number Diff line number Diff line Loading @@ -50,11 +50,11 @@ calculating the normals. NOTE: This potential (ILP) is intended for interlayer interactions between two different layers of graphene, hexagonal boron nitride (h-BN) and their hetero-junction. To perform a realistic simulation, this potential must be used in combination with intra-layer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intra-layer properties unaffected, the interlayer interaction intralayer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intralayer properties unaffected, the interlayer interaction within the same layers should be avoided. Hence, each atom has to have a layer identifier such that atoms residing on the same layer interact via the appropriate intra-layer potential and atoms residing on different layers appropriate intralayer potential and atoms residing on different layers interact via the ILP. Here, the molecule id is chosen as the layer identifier, thus a data file with the "full" atom style is required to use this potential. Loading Loading @@ -117,6 +117,7 @@ units, if your simulation does not use {metal} units. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style pair_kolmogorov_crespi_z"_pair_kolmogorov_crespi_z.html, "pair_style pair_kolmogorov_crespi_full"_pair_kolmogorov_crespi_full.html, "pair_style pair_lebedeva_z"_pair_lebedeva_z.html, Loading doc/src/pair_kolmogorov_crespi_full.txt +4 −3 Original line number Diff line number Diff line Loading @@ -44,12 +44,12 @@ can be found in pair style "ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. NOTE: This potential (ILP) is intended for interlayer interactions between two different layers of graphene. To perform a realistic simulation, this potential must be used in combination with intra-layer potential, such as must be used in combination with intralayer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intra-layer properties unaffected, the interlayer interaction To keep the intralayer properties unaffected, the interlayer interaction within the same layers should be avoided. Hence, each atom has to have a layer identifier such that atoms residing on the same layer interact via the appropriate intra-layer potential and atoms residing on different layers appropriate intralayer potential and atoms residing on different layers interact via the ILP. Here, the molecule id is chosen as the layer identifier, thus a data file with the "full" atom style is required to use this potential. Loading Loading @@ -106,6 +106,7 @@ units. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style pair_lebedeva_z"_pair_lebedeva_z.html, "pair_style kolmogorov/crespi/z"_pair_kolmogorov_crespi_z.html, "pair_style ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. Loading doc/src/pair_kolmogorov_crespi_z.txt +1 −0 Original line number Diff line number Diff line Loading @@ -59,6 +59,7 @@ package"_Build_package.html doc page for more info. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. "pair_style kolmogorov/crespi/full"_pair_kolmogorov_crespi_full.html, "pair_style lebedeva/z"_pair_lebedeva_z.html Loading Loading
doc/src/Commands_pair.txt +1 −0 Original line number Diff line number Diff line Loading @@ -80,6 +80,7 @@ OPT. "dpd/fdt/energy (k)"_pair_dpd_fdt.html, "dpd/tstat (go)"_pair_dpd.html, "dsmc"_pair_dsmc.html, "drip"_pair_drip.html, "eam (gikot)"_pair_eam.html, "eam/alloy (gikot)"_pair_eam.html, "eam/cd (o)"_pair_eam.html, Loading
doc/src/lammps.book +1 −0 Original line number Diff line number Diff line Loading @@ -572,6 +572,7 @@ pair_dipole.html pair_dpd.html pair_dpd_fdt.html pair_dsmc.html pair_drip.html pair_eam.html pair_edip.html pair_eff.html Loading
doc/src/pair_ilp_graphene_hbn.txt +4 −3 Original line number Diff line number Diff line Loading @@ -50,11 +50,11 @@ calculating the normals. NOTE: This potential (ILP) is intended for interlayer interactions between two different layers of graphene, hexagonal boron nitride (h-BN) and their hetero-junction. To perform a realistic simulation, this potential must be used in combination with intra-layer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intra-layer properties unaffected, the interlayer interaction intralayer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intralayer properties unaffected, the interlayer interaction within the same layers should be avoided. Hence, each atom has to have a layer identifier such that atoms residing on the same layer interact via the appropriate intra-layer potential and atoms residing on different layers appropriate intralayer potential and atoms residing on different layers interact via the ILP. Here, the molecule id is chosen as the layer identifier, thus a data file with the "full" atom style is required to use this potential. Loading Loading @@ -117,6 +117,7 @@ units, if your simulation does not use {metal} units. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style pair_kolmogorov_crespi_z"_pair_kolmogorov_crespi_z.html, "pair_style pair_kolmogorov_crespi_full"_pair_kolmogorov_crespi_full.html, "pair_style pair_lebedeva_z"_pair_lebedeva_z.html, Loading
doc/src/pair_kolmogorov_crespi_full.txt +4 −3 Original line number Diff line number Diff line Loading @@ -44,12 +44,12 @@ can be found in pair style "ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. NOTE: This potential (ILP) is intended for interlayer interactions between two different layers of graphene. To perform a realistic simulation, this potential must be used in combination with intra-layer potential, such as must be used in combination with intralayer potential, such as "AIREBO"_pair_airebo.html or "Tersoff"_pair_tersoff.html potential. To keep the intra-layer properties unaffected, the interlayer interaction To keep the intralayer properties unaffected, the interlayer interaction within the same layers should be avoided. Hence, each atom has to have a layer identifier such that atoms residing on the same layer interact via the appropriate intra-layer potential and atoms residing on different layers appropriate intralayer potential and atoms residing on different layers interact via the ILP. Here, the molecule id is chosen as the layer identifier, thus a data file with the "full" atom style is required to use this potential. Loading Loading @@ -106,6 +106,7 @@ units. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style pair_lebedeva_z"_pair_lebedeva_z.html, "pair_style kolmogorov/crespi/z"_pair_kolmogorov_crespi_z.html, "pair_style ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. Loading
doc/src/pair_kolmogorov_crespi_z.txt +1 −0 Original line number Diff line number Diff line Loading @@ -59,6 +59,7 @@ package"_Build_package.html doc page for more info. "pair_coeff"_pair_coeff.html, "pair_none"_pair_none.html, "pair_style hybrid/overlay"_pair_hybrid.html, "pair_style drip"_pair_drip.html, "pair_style ilp/graphene/hbn"_pair_ilp_graphene_hbn.html. "pair_style kolmogorov/crespi/full"_pair_kolmogorov_crespi_full.html, "pair_style lebedeva/z"_pair_lebedeva_z.html Loading
