Recent content by corydalus

You can get the vectors \vec{g_1}, \vec{g_2}, \vec{g_3} without using any matrices. To do this use the following formulas: \vec{g_1}=2\pi\frac{[\vec{a_2},\vec{a_3}]}{\vec{a_1}[\vec{a_2},\vec{a_3}]}, \vec{g_2}=2\pi\frac{[\vec{a_3},\vec{a_1}]}{\vec{a_1}[\vec{a_2},\vec{a_3}]}...

First of all, in my reply I primarily was talking about the simulations including some kind of physics. The question was about "comp. phy. ; emphasizing particles,chemical,physical problems,solid state,q.m,nanotech..." after all. I agree completely that in some fields C++ may be much better than...

I am planning to do some simulations using path integral molecular dynamics approach. I have never used it before, so I would like to have some information concerning packages that are used for that kind of simulations. I am aware of PINY and CPMD packages for PIMD. Which one is better? Are...

Every simulation is based on physics (classical and quantum mechanics, and statistical physics in the most part of cases), therefore, you have to study physics. Actually physics here is the most important thing. Programming is also required of course. The favorite programming language of...