Hi all,<br><br>I run an energy minization, then calculated the energy, obtained the following results:<br><br clear="all">LJ-(SR) -4431.62 1905.29 1886.7 -27.08 -919.923<br>Coulomb-(SR) -
35926.5 14398.4 14389.9 -50.5129 -1715.95<br>Potential -46818.1 20524.5 20248.7 -341.91 -11614.9<br>Kinetic-En. 0 0 0 0 0<br>
Total-Energy 0 0 0 0 0<br>Temperature 0 0 0 0 0<br><br>Why the Total-energy is not the sum of Potential and Kinetic-En.? Thanks!