Chemical Physics Letters

Chemical Physics Letters, Vol.676 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (28 articles)

1 - 5	Generalized Shannon's entropy as generator of local density functionals Flores-Gallegos N
6 - 11	NMR investigation of substituent effects on strength the intramolecular hydrogen bonding interaction in X-phenylhydrazones switches: A theoretical study Gholipour A, Neyband RS, Farhadi S
12 - 17	Determination of the absolute binding free energies of HIV-1 protease inhibitors using non-equilibrium molecular dynamics simulations Ngo ST, Nguyen MT, Nguyen MT
18 - 24	Water-soluble Au-13 clusters protected by binary thiolates: Structural accommodation and the use for chemosensing Ding WH, Huang CQ, Guan LM, Liu XH, Luo ZX, Li WX
25 - 31	Molecular mechanism of the dark-state recovery in BLUF photoreceptors Khrenova MG, Domratcheva T, Nemukhin AV
32 - 38	Configuration and energy landscape of the benzonitrile anion Kirnosov N, Adamowicz L
39 - 45	An excellent stable fluorescent probe: Selective and sensitive detection of trace amounts of Hg+2 ions in natural source of water Singh R, Rai SK, Tiwari MK, Mishra A, Tewari AK, Mishra PC, Singh RK
46 - 52	Structural analysis of flavonoids in solution through DFT H-1 NMR chemical shift calculations: Epigallocatechin, Kaempferol and Quercetin De Souza LA, Tavares WMG, Lopes APM, Soeiro MM, De Almeida WB
53 - 57	Different CO2 absorbents-modified SBA-15 sorbent for highly selective CO2 capture Liu XW, Zhai XR, Liu DY, Sun Y
58 - 64	On the hydration and conformation of cocaine in solution Gillams RJ, Lorenz CD, McLain SE
65 - 69	Chemical interface damping of single gold nanorods with low sensitivity to the medium dielectric constant Ha JW
70 - 76	Ferrocene-based diradicals of imino nitroxide, nitronyl nitroxide and verdazyl, and their cations are possible SMM: A quantum chemical study Pal AK, Datta SN
77 - 81	A time-dependent quantum dynamical study of the O(P-3) + D-2(+) -> OD+ + D reaction Zhang AJ, Zang KL, Jia JF, Wu HS, Yi-Wang, Zhao GJ
82 - 88	Photovoltaic characterization of graphene/silicon Schottky junctions from local and macroscopic perspectives Hajkova Z, Ledinsky M, Vetushka A, Stuchlik J, Muller M, Fejfar A, Bousa M, Kalbac M, Frank O
89 - 94	Computational prediction of endohedral dimetalloborofullerenes M-2@B-80 (M = Sc, Y) Liu C, Yang L, Jin P, Hou QH, Li LL
95 - 98	Molecular modelling and quantum mechanical calculations of the hydration free energy of buckminsterfullerene Luzhkov VB, Volokhov VM, Pokatovich GA
99 - 107	Surfactant concentration dependent metachromasy of an anionic cyanine dye in adsorbed and deposited Langmuir films Shil A, Hussain SA, Bhattacharjee D
108 - 111	Differential interference contrast microscopy imaging of single gold nanospheres beyond the quasi-static limit Lee SY, Kim GW, Ha JW
112 - 117	Determination of pK(a) constants of hypericin in aqueous solution of the anti-allergic hydrotropic drug Cromolyn disodium salt Kesa P, Antalik M
118 - 123	Chirp control of multi-photon resonance ionization and charge-resonance enhanced ionization on molecular harmonic generation Liu H, Li WL, Feng LQ
124 - 128	Exploring the effect of oxygen coverage on the electronic, magnetic and chemical properties of Ni(111) supported h-BN sheet: A density functional study Wasey AHMA, Das GP, Majumder C
129 - 133	Theoretical investigation of the weak interaction between graphene and alcohol solvents Wang HN, Chen SA, Lu SF, Xiang Y
134 - 139	Plasmon-enhanced phosphorescence of hybrid thin films of metal-free purely organic phosphor and silver nanoparticles Seo C, Lee J, Kim MS, Lee Y, Jung J, Shin HW, Ahn TK, Sun G, Kim J, Kim J
140 - 143	Continuity of heavy Rydberg behaviour in the ungerade ion-pair states of H-2 Chartrand AM, Donovan RJ, Lawley KP, McCormack EF
144 - 149	A molecular dynamics study on the adsorption of a mussel protein on two different films: Polymer film and a SAM He CX, Zhang H, Lin CG, Wang L, Yuan SL
150 - 153	Partition function of improved Tietz oscillators Jia CS, Wang CW, Zhang LH, Peng XL, Zeng R, You XT
154 - 168	N-2 elimination thermolysis reactions of 9-(4-and 5-substituted-1,2,3-triazol-1-yl)acridines to produce 1H-pyrido-[4,3,2-kl] derivatives - A theoretical study Taherpour A, Ghasemhezaveh F, Yari A, Khodaei MM
169 - 173	Exactly solvable Schrodinger equation with double-well potential for hydrogen bond Sitnitsky AE