Identification and Characterization of Chemistry of Different Radicals in Mainstream Gas- phase Cigarette Smoke by ESI-MS method

Identification of Amino Acid Sequences with Good Folding Properties in an Off-Lattice Model

Identification of the Atomic Scale Structures of the Gold-Thiol Interfaces of Molecular Nanowires by Inelastic Tunneling Spectroscopy

Identification of the Molecule-Metal Bonding Geometries of Molecular Nanowires

Imaginary time Gaussian dynamics of the Ar_3 cluster

Impact of Interatomic Electronic Decay Processes on Xe 4d Hole Decay in the Xenon Fluorides

Impact of the Electron Density on the Fixed-Node Errors in Quantum Monte Carlo

Impedance Spectra of Mixed Conductors: a 2D Study of Ceria

Implicit Density Functional Theory

Importance of electronic self-consistency in the TDDFT based treatment of nonadiabatic molecular dynamics

Improved Ionic Model of Liquid Uranium Dioxide

Improved Nearside-Farside Decomposition of Elastic Scattering Amplitudes

Improving Guess Geminals for the Geminal Mean Field Configuration Interaction Method

In search of a structural model for a thiolate-protected Au38 cluster

Incoherent charge transport through molecular wires: interplay of Coulomb interaction and wire population

Incoherent Quasielastic Neutron Scattering Study of Molecular dynamics of 4-n-cyano-4'-octylbiphenyl

Independent components in spectroscopic analysis of complex mixtures

Indirect Dissociative Recombination of LiH$^+$ Molecules Fueled by Complex Resonance Manifolds

Indirect dissociative recombination of LiH$_2^+$ + e$^-$

Induced parameter-dependent optimization method applied to reaction rate determination