The interaction energy between two black holes at large separation distance is calculated. The first term in the expansion corresponds to the Newtonian interaction between the masses. The second term corresponds to the spin-spin interaction. The calculation is based on the interaction energy defined on the two black holes initial data. No test particle approximation is used. The relation betwee...

In this investigation, the interaction of C20 and Si2H2 molecules was explored in the M06-2X/6-311++G(d,p)level of theory in gas solution phases. The obtained interaction energy values with standard method werecorrected by basis set superposition error (BSSE) during the geometry optimization for all molecules atthe same level of theory. Also, the bonding interaction between th...

In this paper, using Monte Carlo Fortran code, we have obtained the binding energies for three different systems of diquark–antidiquark in distances from 0.01 to 15 nm. In [0.1 - 15] nm interval, we made use of Coulomb potential because in this interval, strong interaction is negligible. We have compared the binding energies of the systems with one another. The results of these comparisons...

linear–dendrite copolymers containing hyper branched poly(citric acid) and linear poly(ethylene glycol) blocks pca–peg–pca are promising nonmaterial to use  in nanomedicine. to investigate their potential application in biological systems (especially for drug carries) oniom2 calculations were applied to study the nature of particular interactions between drug and the polymeric nanoparticles.  b...

an interaction potential at different orientation for the ch4 and co2 complex was derived at theb3lyp level of theory and 6-31+g* basis sets. the potential energy surface was computed on somemolecular geometries. the complete basis set limit of the interaction energies were fitted to wellknownanalytical functions. to determine the second virial coefficients b, u(r) is used to obtain themodel’s ...

in this paper we have down three theoretical study by using monte carlo simulation and mm+,amber and opls force field. the calculations were carried out using hyper chem professional,release 7.01 package of program. first we have studied the interaction of h2 molecule and he atomwith single-walled carbon nanotube at different temperature. for doing this study we placed h2 andhe in the center an...