Terahertz absorption spectra have been recorded for the weakly bound CO2-H2O complex embedded in cryogenic neon matrices at 2.8 K. The three high-frequency van der Waals vibrational transitions associated with out-of-plane wagging, in-plane rocking, and torsional motion of the isotopic H2O subunit have been assigned and provide crucial observables for benchmark theoretical descriptions of this ...

We present a new approach to calculate the attractive long-range vortex-vortex interaction of the van der Waals type present in anisotropic and layered superconductors. The mapping of the statistical mechanics of two-dimensional charged bosons allows us to define a Casimir problem: Two half spaces of vortex matter separated by a gap of width R are mapped to two dielectric half planes of charged...

Ž . The canonical molecular dynamics MD simulation was accelerated by the integrated method of the multiple time-step Ž . integrator algorithm combined with the particle mesh Ewald method PMEM applied not only to the calculation of the Coulomb interaction but also of the Van der Waals interaction. Although the previous integrated method, in which the PMEM was used in the calculation only for th...

a new modified adomian decomposition method (adm) is utilized to obtain an analytical solution for buckling of the nanocantilever actuators immersed in liquid electrolytes. the nanoactuators in electrolytes are subject to different nonlinear forces including ionic concentration, van der waals, external voltage and electrochemical forces. the duan–rach modified adomian decomposition method is ut...

the crystal structure of the compound c20 h24 n2 o24 was determined by direct methods. thecrystals are monoclinic, space group p21/n, and unit cell parameters are: a= 10.2342 (9), b=4.8763 (5),c=19.3578 (11) a, β =98.9632 (10) o ,v=956.6 (5) a3, z=2, dc=1.239grm-3, dm=1.22grm-3. the final rfactorsare converged to r=0.059 and rw=0.056 for 553 independent observed reflections. themolecules are li...

in this paper, the radial breathing mode (rbm) frequencies of multi-walled carbon nanotubes (mwcnts) are  obtained based on the multiple-elastic thin shell model. for this purpose, mwcnt is considered as a multiple concentric elastic thin cylindrical shells, which are coupled through van der waals (vdw) forces between two adjacent tubes. lennard-jones potential is used to calculate the vdw forc...

Previous work on the cooperative behavior of lattices of interacting two-state enzyme molecules at steady state is extended here to interacting three-state enzyme molecules with a one-way cycle. The Bragg-Williams (mean field) approximation is used. A phase-transition example with a bifurcation point is discussed. Compared to conventional phase transitions (with a van der Waals loop), several ...

In this work 1 the curvature of Weinhold (thermodynamical) metric is studied in the case of systems with two thermodynamical degrees of freedom. Conditions for the Gauss curvature R to be zero, positive or negative are worked out. Signature change of the Weinhold metric and the corresponding singular behavior of the curvature at the phase boundaries are studied. Cases of systems with the consta...

After last six year e orts which are manifested by hundreds of papers on the physics, chemistry of the fullerenes and the fullerene based materials it is known a lot about the electronic structure of the single macromolecule which is the base of the di erent materials like the doped solids and the chemical adducts. A variety of the computational methods, from ab initio calculation to an empiric...