Chemical Physics Letters

Chemical Physics Letters, Vol.682 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (30 articles)

1 - 5	Shape similarity of charge-transfer (CT) excitation energy curves in a series of donor-acceptor complexes and its description with a transferable energy of CT orbital Gritsenko OV
6 - 14	Comparative evaluation of the stability of seven-transmembrane microbial rhodopsins to various physicochemical stimuli Honda N, Tsukamoto T, Sudo Y
15 - 19	On the suitability of high vacuum electrospray deposition for the fabrication of molecular electronic devices Temperton RH, O'Shea JN, Scurr DJ
20 - 25	Superalkali@C-60-superhalogen: Structure and nonlinear optical properties of a new class of endofullerene complexes Srivastava AK, Kumar A, Misra N
26 - 29	Exploration of peptides that fit into the thermally vibrating active site of cathepsin K protease by alternating artificial intelligence and molecular simulation Nishiyama K
30 - 33	Unusual chemical bonding in the beryllium dimer and its twelve vibrational levels Mitin AV
34 - 37	Two-color resonant two-photon ionization and mass-analyzed threshold ionization spectroscopy of 4-chlorostyrene Wu PY, Huang HH, Lin KC, Tzeng WB
38 - 42	Comparative study of semilocal density functionals on solids and surfaces Mo YX, Tian GC, Tao JM
43 - 48	Structural and thermodynamic investigation of pentoxifylline-cyclodextrin inclusion complex Morais CAS, Silva BL, Denadai AML, Lopes JF, De Sousa FB
49 - 54	A DFT study on the catalytic hydrogenation of CO2 to formic acid over Ti-doped graphene nanoflake Esrafili MD, Dinparast L
55 - 59	A molecular simulation study of the auto-protolysis of ammonia as a function of temperature Zahn D
60 - 63	Mass spectrometric study of N-2-adsorption on copper cluster cations formed by modulated pulsed power magnetron sputtering in aggregation cell Ohshimo K, Mizuuchi I, Akimoto K, Tsukamoto K, Tona M, Yamamoto H, Nakano M, Misaizu F
64 - 70	y Three-dimensional nanoporous MoS2 framework decorated with Au nanoparticles for surface-enhanced Raman scattering Sheng YQ, Jiang SZ, Yang C, Liu M, Liu AH, Zhang C, Li Z, Huo YY, Wang MH, Man BY
71 - 76	Quantum dot sensitized solar cells: Light harvesting versus charge recombination, a film thickness consideration Wang XW, Wang YF, Zeng JH, Shi F, Chen Y, Jiang JX
77 - 81	Peculiarities of migration and capture of a quantum particle in a chain with traps Christophorov LN, Zagorodny AG
82 - 86	An approach to the averaged intermolecular potential field of methane from viscosity Zhang AL, Yang XH, Zhang SX
87 - 90	Explicitly-correlated non-born-oppenheimer calculations of the HD molecule in a strong magnetic field Adamowicz L, Stanke M, Tellgren E, Helgaker T
91 - 95	Site symmetry approach in the supercell model of carbon-doped ZnO bulk Evarestov RA, Piskunov S, Zhukovskii YF
96 - 100	Synthesis of polyynes by intense femtosecond laser irradiation of SWCNTs suspended in methanol Zhao JW, Zhang YF, Fang YH, Fan ZF, Ma GH, Liu Y, Zhao XL
101 - 107	Sodium acetate assisted hydrothermal growth of dumbbell-like beta-NaGdF4 nanobundles: Morphology control and products transformation Wu KL, Wang YY, Xia TL
108 - 114	Metastability of the low-lying electronic states of CBr2+: A CASSCF/MRCI study Lins IA, Belinassi AR, Ornellas FR, Alves TV
115 - 121	Insight into CH4 formation and chain growth mechanism of Fischer - Tropsch synthesis on theta-Fe3C(031) Wang YF, Li Y, Huang SY, Wang J, Wang HY, Lv J, Ma XB
122 - 127	Effects of head type on the stability of gemini surfactant foam by molecular dynamics simulation Wu G, Yuan CT, Ji XJ, Wang HB, Sun SQ, Hu SQ
128 - 132	Synthesis and photoeletrochemical performance of AuAg@CdS double-walled nanotubes Guan SD, Fu XL, Tang Y, Peng ZJ
133 - 139	D-A dyad and D-A-D triad incorporating triphenylamine, benzanthrone and perylene diimide: Synthesis, electrochemical, linear and nonlinear optical properties Cao L, Xu L, Zhang DF, Zhou YC, Zheng YS, Fu QR, Jiang XF, Lu FS
140 - 146	Preparation and characterization of Ag-doped In2O3 nanoparticles gas sensor Anand K, Kaur J, Singh RC, Thangaraj R
147 - 153	Micelles entrapped Cresyl Violet can selectively detect copper and mercury ions in solution: A fluorescence Correlation Spectroscopy investigation Das NK, Ghosh S, Jaiswal S, Tewary A, Mukherjee S
154 - 159	Kinetics of gas phase OH radical reaction with thiophene in the 272-353 K temperature range: A laser induced fluorescence study Kawade MN, Srinivas D, Upadhyaya HP
160 - 167	Predicting optimal finite field strengths for calculating the first and second hyperpolarizabilities using simple molecular descriptors Mohammed AAK, Limacher PA, Ayers PW
168 - 174	Part II: Quantum mechanical prediction of heats of adsorption for C-2-C-4 hydrocarbons in MOF-74-Mg/Zn periodic structures Degaga GD, Valenzano L