Melting transition of confined Lennard-Jones solids in slit pores Chandan K. DasJayant K. Singh Regular Article 28 February 2013 Article: 1351
Hexagonal boron nitride on transition metal surfaces Jaime Gómez DíazYun DingJürg Hutter Feature Article Open access 27 February 2013 Article: 1350
Isotope effects on the dynamics properties and reaction mechanism in the Cl(2P) + NH3 reaction: a QCT and QM study Manuel Monge-PalaciosCipriano RangelMinghui Yang Regular Article 19 February 2013 Article: 1349
Rank-dependent orientational relaxation in an ionic liquid: an all-atom simulation study Tamisra PalRanjit Biswas Regular Article 16 February 2013 Article: 1348
Cooperativity of hydrogen and halogen bond interactions Sławomir J. Grabowski Regular Article 07 February 2013 Article: 1347
Exohedral interaction in cationic lithium metallofullerenes Maitreyi RobledoFernando MartínSergio Díaz-Tendero Regular Article 08 February 2013 Article: 1346
Simulating the optical properties of CdSe clusters using the RT-TDDFT approach Roger NadlerJavier Fdez Sanz Regular Article 09 February 2013 Article: 1342
From clusters to liquid: what are the preferred ways for benzene and pyrrole to interact? Wei GaoJiqing JiaoLiuping Chen Regular Article 06 February 2013 Article: 1340
Numerical investigation of the elastic scattering of hydrogen (isotopes) and helium at graphite (0001) surfaces at beam energies of 1 to 4 eV using a split-step Fourier method Stefan E. HuberTobias HellAlexander Ostermann Regular Article Open access 07 February 2013 Article: 1337
A theoretical investigation of the CO2-philicity of amides and carbamides Luis Miguel AzofraMuhannad AltarshaFrancesca Ingrosso Regular Article 16 February 2013 Article: 1326
