What other properties ? Do not expect classical MD to calculate Magnetic or optical properties (dielectric constants) as these are electron related and outside of the realm of classical mechanics. However it is due possible calculate thermodynamical properties like Pressure , temperature, melting and the equation of state as long your simulation is on valid constraints of classical mechanics i.e Newtonian equations . Remember macroscopic properties are linked due the Statistical averages. For example , it is well know the average motion of the atoms (kinetic energy) can be equivalent to the temperature . In MD you usually have the atomic positions, initial velocities and the interaction between the atoms (potential) . Please look at my series of videos as they will help you understand Better https://www.youtube.com/watch?v=0POaI_3w2Zc

From the stress you can calculate the elastic constants and I explain in this Video a little bit about the topic : https://www.youtube.com/watch?v=s9ZkpO9ijO4&t=1196s

MD is a atomistic method and its outside of the Continuum (solving partial differential equations) . There has been attempts to combine MD with Finite element methods MDFEM . What your trying to achieve is what is commonly know as MULTI-SCALE METHODS http://www.scholarpedia.org/article/Multiscale_modeling

There is a folder after extracting LAMMPS package, named atc in lib folder lammps*/lib/atc. It says that:

ATC (Atom To Continuum methods)

Reese Jones, Jeremy Templeton, Jonathan Zimmerman (Sandia National Labs)

rjones, jatempl, jzimmer at sandia.gov

September 2009

This is version 1.0 of the ATC library, which provides continuum field

estimation and molecular dynamics-finite element coupling methods.

-------------------------------------------------

This directory has source files to build a library that LAMMPS

links against when using the USER-ATC package.

This library must be built with a C++ compiler, before LAMMPS is

built, so LAMMPS can link against it.

You can type "make lib-atc" from the src directory to see help on how

to build this library via make commands, or you can do the same thing

by typing "python Install.py" from within this directory, or you can

do it manually by following the instructions below.

Build the library using one of the provided Makefile.* files or create

your own, specific to your compiler and system. For example:

make -f Makefile.g++

Note that the ATC library makes MPI calls, so you must build it with

the same MPI library that is used to build LAMMPS, i.e. as specified

by settings in the lammps/src/MAKE/Makefile.machine file you are

using.

When you are done building this library, two files should

exist in this directory:

libatc.a the library LAMMPS will link against

Makefile.lammps settings the LAMMPS Makefile will import

Makefile.lammps is created by the make command, by copying one of the

Makefile.lammps.* files. See the EXTRAMAKE setting at the top of the

Makefile.* files.

IMPORTANT: You must examine the final Makefile.lammps to insure it is

correct for your system, else the LAMMPS build will likely fail.

Makefile.lammps has settings for 3 variables:

user-atc_SYSINC = leave blank for this package

user-atc_SYSLIB = BLAS and LAPACK libraries needed by this package

user-atc_SYSPATH = path(s) to where those libraries are

You have 3 choices for these settings:

a) If the 2 libraries are already installed on your system, the

settings in Makefile.lammps.installed should work.

b) If they are not, you can install them yourself, and specify the

appropriate settings accordingly in a Makefile.lammps.* file

and set the EXTRAMAKE setting in Makefile.* to that file.

c) Use the minimalist version of these libraries provided with LAMMPS

in lib/linalg, by using Makefile.lammps.linalg. In this case you also

need to build the library in lib/linalg; see the lib/linalg/README

file for more details.

So, the answer is yes, but not for magnetic properties.