Loading doc/pair_eam.html +13 −11 Original line number Diff line number Diff line Loading @@ -81,6 +81,19 @@ to model alloy systems by invoking the <I>eam/alloy</I> or <I>eam/fs</I> styles as described below. These files require no mixing since they specify alloy interactions explicitly. </P> <P>There are several WWW sites that distribute and document EAM potentials stored in either the original DYNAMO or other formats: </P> <PRE>http://www.ctcms.nist.gov/potentials http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm </PRE> <P>These potentials should be usable with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described on this page. </P> <HR> <P>For style <I>eam</I>, potential values are read from a file that is in the DYNAMO single-element <I>funcfl</I> format. If the DYNAMO file was created by a Fortran program, it cannot have "D" values in it for exponents. Loading Loading @@ -356,17 +369,6 @@ the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for more info. </P> <P><A HREF = "pair_coeff.html">pair_coeff</A> </P> <P>Here are several WWW sites that discuss EAM potentials stored in either the original DYNAMO or other formats: </P> <PRE>http://www.ims.uconn.edu/centers/simul/pot http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm </PRE> <P>In principle, these potentials could be used with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described above. </P> <P><B>Default:</B> none </P> <HR> Loading doc/pair_eam.txt +13 −11 Original line number Diff line number Diff line Loading @@ -73,6 +73,19 @@ to model alloy systems by invoking the {eam/alloy} or {eam/fs} styles as described below. These files require no mixing since they specify alloy interactions explicitly. There are several WWW sites that distribute and document EAM potentials stored in either the original DYNAMO or other formats: http://www.ctcms.nist.gov/potentials http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm :pre These potentials should be usable with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described on this page. :line For style {eam}, potential values are read from a file that is in the DYNAMO single-element {funcfl} format. If the DYNAMO file was created by a Fortran program, it cannot have "D" values in it for exponents. Loading Loading @@ -348,17 +361,6 @@ the "Making LAMMPS"_Section_start.html#2_3 section for more info. "pair_coeff"_pair_coeff.html Here are several WWW sites that discuss EAM potentials stored in either the original DYNAMO or other formats: http://www.ims.uconn.edu/centers/simul/pot http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm :pre In principle, these potentials could be used with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described above. [Default:] none :line Loading Loading
doc/pair_eam.html +13 −11 Original line number Diff line number Diff line Loading @@ -81,6 +81,19 @@ to model alloy systems by invoking the <I>eam/alloy</I> or <I>eam/fs</I> styles as described below. These files require no mixing since they specify alloy interactions explicitly. </P> <P>There are several WWW sites that distribute and document EAM potentials stored in either the original DYNAMO or other formats: </P> <PRE>http://www.ctcms.nist.gov/potentials http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm </PRE> <P>These potentials should be usable with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described on this page. </P> <HR> <P>For style <I>eam</I>, potential values are read from a file that is in the DYNAMO single-element <I>funcfl</I> format. If the DYNAMO file was created by a Fortran program, it cannot have "D" values in it for exponents. Loading Loading @@ -356,17 +369,6 @@ the <A HREF = "Section_start.html#2_3">Making LAMMPS</A> section for more info. </P> <P><A HREF = "pair_coeff.html">pair_coeff</A> </P> <P>Here are several WWW sites that discuss EAM potentials stored in either the original DYNAMO or other formats: </P> <PRE>http://www.ims.uconn.edu/centers/simul/pot http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm </PRE> <P>In principle, these potentials could be used with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described above. </P> <P><B>Default:</B> none </P> <HR> Loading
doc/pair_eam.txt +13 −11 Original line number Diff line number Diff line Loading @@ -73,6 +73,19 @@ to model alloy systems by invoking the {eam/alloy} or {eam/fs} styles as described below. These files require no mixing since they specify alloy interactions explicitly. There are several WWW sites that distribute and document EAM potentials stored in either the original DYNAMO or other formats: http://www.ctcms.nist.gov/potentials http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm :pre These potentials should be usable with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described on this page. :line For style {eam}, potential values are read from a file that is in the DYNAMO single-element {funcfl} format. If the DYNAMO file was created by a Fortran program, it cannot have "D" values in it for exponents. Loading Loading @@ -348,17 +361,6 @@ the "Making LAMMPS"_Section_start.html#2_3 section for more info. "pair_coeff"_pair_coeff.html Here are several WWW sites that discuss EAM potentials stored in either the original DYNAMO or other formats: http://www.ims.uconn.edu/centers/simul/pot http://cst-www.nrl.navy.mil/ccm6/ap http://enpub.fulton.asu.edu/cms/potentials/main/main.htm :pre In principle, these potentials could be used with LAMMPS, though the alternate formats would need to be converted to the DYNAMO format used by LAMMPS and described above. [Default:] none :line Loading
