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Physical Review. B: Condensed Matter and Materials Physics, ISSN 1098-0121, 04/2012, Volume 85, Issue 15
Journal Article
International Journal of Quantum Chemistry, ISSN 0020-7608, 09/2013, Volume 113, Issue 18, pp. 2172 - 2179
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 2002, Volume 117, Issue 18, pp. 8442 - 8453
A consistent derivation is given for local field factors to be used for correcting measured or calculated static (hyper)polarizabilities in the condensed... 
MOLECULAR-SURFACES | CAVITY | OPTICAL-PROPERTIES | DIPOLE INTERACTION-MODEL | CONTINUUM | ELECTROSTATIC INTERACTION | SOLVENT | PI-ASTERISK<-N TRANSITION | CHARGE PENETRATION | HYPERPOLARIZABILITIES | TRANSITION | CONSISTENT | DIELECTRIC CONTINUUM | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 01/2011, Volume 134, Issue 4, pp. 044514 - 044514-11
We present a benchmark study of a combined multipole shielding polarizability/reaction field (MSP/RF) approach to the calculation of both specific and bulk... 
MOLECULAR-DYNAMICS | WAVE-FUNCTIONS | RESPONSE FUNCTIONS | ATOMS LI | SELF-CONSISTENT-FIELD | CHEMICAL-SHIFTS | ELECTRIC-FIELD | NUCLEAR-MAGNETIC-RESONANCE | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | LIQUID WATER | GAUSSIAN-BASIS SETS
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 08/2003, Volume 119, Issue 7, pp. 3849 - 3870
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 01/2014, Volume 10, Issue 1, pp. 211 - 219
The CMIRS1.0 (composite method for implicit representation of solvent, Version 1.0) model is introduced for efficacious and inexpensive computation of... 
REPULSION CONTRIBUTIONS | SELF-CONSISTENT-FIELD | CONTINUUM SOLVATION | DISPERSION CONTRIBUTION | CLUSTERS | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | BASIS-SETS | REACTION FIELD TREATMENT | VOLUME POLARIZATION | FORMULATION | SIMPLE COMPUTATIONAL MODEL
Journal Article
Journal of Photochemistry & Photobiology, A: Chemistry, ISSN 1010-6030, 1997, Volume 105, Issue 2, pp. 165 - 181
Journal Article
Izvestiya Vysshikh Uchebnykh Zavedenii, Seriya Khimiya i Khimicheskaya Tekhnologiya, ISSN 0579-2991, 2018, Volume 61, Issue 8, pp. 17 - 21
Journal Article
JOURNAL OF PHYSICAL CHEMISTRY A, ISSN 1089-5639, 10/1998, Volume 102, Issue 41, pp. 7984 - 7989
The direct reaction field model was used to calculate the solvent shift of the n-pi* transition of acetone in eight different solvents. The computed shifts... 
CONSISTENT | CHEMISTRY, PHYSICAL | STATES | POTENTIALS | POLARIZATION | QUANTUM | Solvents | Research | Molecular spectra | Acetone
Journal Article
Journal of Photochemistry & Photobiology, A: Chemistry, ISSN 1010-6030, 1999, Volume 121, Issue 1, pp. 7 - 15
Journal Article
Journal of Computational Chemistry, ISSN 0192-8651, 09/2012, Volume 33, Issue 25, pp. 2012 - 2022
Journal Article
Theoretical Chemistry Accounts, ISSN 1432-881X, 09/2004, Volume 112, Issue 4, pp. 217 - 227
Journal Article
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