1 - 6 |
Tautomerism in substituted cyanopyridone: Ultrafast dynamics and TDDFT studies in water Saleh N, Graham JP, Nawaz M, Hisaindee S, Rauf MA |
7 - 9 |
Accurate rotational barrier calculations with diffusion quantum Monte Carlo Klahm S, Luchow A |
10 - 14 |
Raman spectra of electrochemically hydrogenated diamond like carbon surface Biswas HS, Datta J, Sen P, Ghosh UC, Ray NR |
15 - 20 |
Time-dependent change of Hyper-Rayleigh Scattering from silver nanoparticle aggregates induced by salt Kim JH, Park JS, Kim MG |
21 - 28 |
Rotational excitation of AlH by Helium and Neon at low temperature: State-to-state inelastic cross section Pamboundom M, Fifen JJ, Nkem C, Nsangou M |
29 - 33 |
Sizes distributions of large He droplets Sliter R, Gomez LF, Kwok J, Vilesov A |
34 - 37 |
Photon avalanche upconversion in Ho3+-Yb3+ co-doped transparent oxyfluoride glass-ceramics Babu P, Martin IR, Krishnaiah KV, Seo HJ, Venkatramu V, Jayasankar CK, Lavin V |
38 - 42 |
Structure of Tm-2 and Tm2C2 encapsulated in low-symmetry C-82(C-s(6)) fullerene cage by single crystal X-ray diffraction Sado Y, Aoyagi S, Izumi N, Kitaura R, Kowalczyk T, Wang J, Irle S, Nishibori E, Sugimoto K, Shinohara H |
43 - 45 |
Vacancy formation energy and size effects Yu XH, Zhan ZL, Rong J, Liu Z, Li L, Liu JX |
46 - 50 |
Fragility and glass transition for binary mixtures of 1,2-propanediol and LiBF4 Terashima Y, Mori M, Sugimoto N, Takeda K |
51 - 55 |
Umbrella sampling of proton transfer in a creatine-water system Ivchenko O, Bachert P, Imhof P |
56 - 61 |
Impact of amphiphilic triblock copolymers on stability and permeability of phospholipid/polymer hybrid vesicles Shen WM, Hu JH, Hu X |
62 - 67 |
Estimation of interfacial tension for immiscible and partially miscible liquid systems by Dissipative Particle Dynamics Goel H, Chandran PR, Mitra K, Majumdar S, Ray P |
68 - 72 |
The bond survival time variation of polymorphic amyloid fibrils in the mechanical insight Lee M, Baek I, Chang HJ, Yoon G, Na S |
73 - 78 |
Adsorption of H2O2 at the surface of I-h ice, as seen from grand canonical Monte Carlo simulations Picaud S, Jedlovszky P |
79 - 86 |
Molecular dynamics study of mixed alkanethiols covering a gold surface at three different arrangements Vasumathi V, Natalia M, Cordeiro DS |
87 - 95 |
The origin of enantioselectivity for intramolecular Friedel-Crafts reaction catalyzed by supramolecular Cu/DNA catalyst complex Petrova GP, Ke ZF, Park S, Sugiyama H, Morokuma K |
96 - 102 |
Tuning the oxidation degree in sub-10 nm silver-oxide nanoparticles: From Ag2O monoxide to AgOx(x > 1) superoxide Tchaplyguine M, Zhang C, Andersson T, Bjorneholm O |
103 - 105 |
Accurate structural parameters and binding energy of the (X)over-tilde(1)A(1) state of diazomethane through coupled-cluster calculations Papakondylis A, Mavridis A |
106 - 111 |
Vibrational properties of water retained in graphene oxide Druzbicki K, Natkaniec I |
112 - 117 |
Assessment of CCSD(T), MP2, DFT-D, CBS-QB3, and G4(MP2) methods for conformational study of alanine and proline dipeptides Kang YK, Park HS |
118 - 122 |
Assessment of amine functionalized graphene nanoflakes for anode materials in Li-ion batteries: An ab initio study Chakraborti H, Pal SK |
123 - 127 |
Suitable helical cavity, suitable alkali metal, larger first hyperpolarizability Gao Y, Sun SL, Xu HL, Su ZM |