Chemical Physics

2.2(top 20%)

impact factor

17.5K(top 1%)

papers

431.3K(top 1%)

citations

164(top 2%)

h-index

2.2(top 20%)

impact factor

19.6K

all documents

439.9K

doc citations

293(top 2%)

g-index

Top Articles

#	Title	Journal	Year	Citations
1	Electrostatic interaction of a solute with a continuum. A direct utilizaion of AB initio molecular potentials for the prevision of solvent effects	Chemical Physics	1981	7,777
2	A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach	Chemical Physics	1980	3,242
3	Self-consistent molecular Hartree—Fock—Slater calculations I. The computational procedure	Chemical Physics	1973	3,106
4	Approximate evaluations of the electrostatic free energy and internal energy changes in solution processes	Chemical Physics	1982	2,222
5	Efficient, approximate and parallel Hartree–Fock and hybrid DFT calculations. A ‘chain-of-spheres’ algorithm for the Hartree–Fock exchange	Chemical Physics	2009	2,010
6	The temperature dependence of positron lifetimes in solid pivalic acid	Chemical Physics	1981	1,699
7	Electrolysis of water on (oxidized) metal surfaces	Chemical Physics	2005	1,383
8	Molecular polarizabilities calculated with a modified dipole interaction	Chemical Physics	1981	1,161
9	The radial distribution functions of water and ice from 220 to 673 K and at pressures up to 400 MPa	Chemical Physics	2000	987
10	Ligand spin polarization and antiferromagnetic coupling in transition metal dimers	Chemical Physics	1986	904
11	N-doped TiO2: Theory and experiment	Chemical Physics	2007	864
12	Outer-sphere electron transfer in polar solvents	Chemical Physics	1980	855
13	Energy-consistent pseudopotentials for group 11 and 12 atoms: adjustment to multi-configuration Dirac–Hartree–Fock data	Chemical Physics	2005	854
14	Electron and lattice dynamics following optical excitation of metals	Chemical Physics	2000	798
15	First-principles based matrix Green's function approach to molecular electronic devices: general formalism	Chemical Physics	2002	701
16	A semiclasical justification for the use of non-spreading wavepackets in dynamics calculations	Chemical Physics	1984	687
17	Empirical potential Monte Carlo simulation of fluid structure	Chemical Physics	1996	683
18	Wavepacket dancing: Achieving chemical selectivity by shaping light pulses	Chemical Physics	1989	645
19	A new determination of the structure of water at 25°C	Chemical Physics	1986	592
20	Lineshapes of molecular aggregates, exchange narrowing and intersite correlation	Chemical Physics	1984	581
21	Carbon nanotube electronics	Chemical Physics	2002	574
22	Proton-transfer reaction dynamics	Chemical Physics	1996	525
23	Mathematical functions for the analysis of luminescence decays with underlying distributions 1. Kohlrausch decay function (stretched exponential)	Chemical Physics	2005	504
24	Role of density fluctuations in bimolecular reaction kinetics	Chemical Physics	1978	499
25	Intermolecular forces in simple systems	Chemical Physics	1977	490
26	DVM-Xα calculations on the ionization potentials of MXk+1− complex anions and the electron affinities of MXk+1 “superhalogens”	Chemical Physics	1981	487
27	Electronic spectra and transitions of the fullerene C60	Chemical Physics	1992	485
28	A systematic study of molecular vibrational anharmonicity and vibration—rotation interaction by self-consistent-field higher-derivative methods. Asymmetric top molecules	Chemical Physics	1988	476
29	Are atoms intrinsic to molecular electronic wavefunctions? I. The FORS model	Chemical Physics	1982	467
30	A model for cw laser induced mode-mismatched dual-beam thermal lens spectrometry	Chemical Physics	1992	466
31	Self-consistent molecular Hartree—Fock—Slater calculations II. The effect of exchange scaling in some small molecules	Chemical Physics	1973	420
32	Specific CI calculation of energy differences: Transition energies and bond energies	Chemical Physics	1993	412
33	Integral cross sections for ion—molecule reactions. I. The guided beam technique	Chemical Physics	1974	410
34	Cooperativity and hydrogen bonding network in water clusters	Chemical Physics	2000	402
35	Estimating the time-zero spectrum in time-resolved emmsion measurements of solvation dynamics	Chemical Physics	1994	397
36	Rotational brownian motion and fluorescence intensify fluctuations	Chemical Physics	1974	389
37	Theoretical study of multiple high-order harmonic generation by intense ultrashort pulsed laser fields: A new generalized pseudospectral time-dependent method	Chemical Physics	1997	384
38	Intermolecular potential functions and the properties of water	Chemical Physics	1982	380
39	A quadratically convergent Hartree—Fock (QC-SCF) method. Application to closed shell systems	Chemical Physics	1981	375
40	Convergence of an improved CIPSI algorithm	Chemical Physics	1983	375
41	Charge transfer transitions in solid tetracene and pentacene studied by electroabsorption	Chemical Physics	1981	373
42	Theory of the time development of the stokes shift in polar media	Chemical Physics	1984	370
43	The effects of solvent on the conformation and the collective motions of protein: Normal mode analysis and molecular dynamics simulations of melittin in water and in vacuum	Chemical Physics	1991	369
44	The J- and H-bands of organic dye aggregates	Chemical Physics	2006	367
45	A quantum chemical approach to dielectric solvent effects in molecular liquids	Chemical Physics	1976	342
46	A theoretical analysis of the sum frequency generation spectrum of the water surface	Chemical Physics	2000	340
47	Noncovalent intermolecular forces in polycrystalline and amorphous saccharides in the far infrared	Chemical Physics	2003	329
48	A response-function approach to the direct calculation of the transition-energy in a multiple-cluster expansion formalism	Chemical Physics	1979	328
49	Radiative and nonradiative electron transfer in contact radical-ion pairs	Chemical Physics	1993	325
50	Theory of inelastic lifetimes of low-energy electrons in metals	Chemical Physics	2000	311

Scientometrics

Overviews

Citing Bodies

Chemical Physics

Top Articles