Richard L. Martin

发表

The materials genome in action: identifying the performance limits for methane storage

Diego A. Gómez-Gualdrón, Maciej Haranczyk, Berend Smit, 2015 .

Molecular and solid-state properties of tris-(8-hydroxyquinolate)-aluminum

Richard L. Martin, J. Kress, I. Campbell, 2000 .

Density functional theory studies of the electronic structure of solid state actinide oxides.

Richard L. Martin, G. Scuseria, T. M. Henderson, 2013, Chemical reviews.

The Hydration Number of Li + in Liquid Water ∗

Richard L. Martin, J. Kress, G. Hummer, 2008 .

Relativistic contributions to the low‐lying excitation energies and ionization potentials of the transition metals

Richard L. Martin, P. Hay, R. L. Martin, 1981 .

CONTROLLING CHARGE INJECTION IN ORGANIC ELECTRONIC DEVICES USING SELF-ASSEMBLED MONOLAYERS

Richard L. Martin, John P. Ferraris, Joel D. Kress, 1997 .

Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional.

Richard L. Martin, Juan E Peralta, Gustavo E Scuseria, 2005, The Journal of chemical physics.

Covalency in f-element complexes

Richard L. Martin, David L. Clark, D. L. Clark, 2013 .

Hybrid density-functional theory and the insulating gap of UO2.

Richard L. Martin, Gustavo E Scuseria, Richard L Martin, 2002, Physical review letters.

Hydrolysis of ferric ion in water and conformational equilibrium

Richard L. Martin, P. Jeffrey Hay, Lawrence R. Pratt, 1998 .

Density functional calculations on first‐row transition metals

Thomas V. Russo, Richard L. Martin, P. Jeffrey Hay, 1994 .

NATURAL TRANSITION ORBITALS

Richard L. Martin, 2003 .

Effective Core Potentials for DFT Calculations

Thomas V. Russo, Richard L. Martin, P. Jeffrey Hay, 1995 .

Microscopic model of carbon monoxide binding to myoglobin

Richard L. Martin, P. Jeffrey Hay, Angel E. Garcia, 2000 .

The Drosophila ninaE gene encodes an opsin

Richard L. Martin, Jay Hirsh, William L. Pak, 1985, Cell.

All-electron relativistic calculations on silver hydride. An investigation of the Cowan-Griffin operator in a molecular species

Richard L. Martin, R. L. Martin, 1983 .

Halogen atomic and diatomic1shole states

Richard L. Martin, Ernest R. Davidson, E. Davidson, 1977 .

Mott transition of MnO under pressure: A comparison of correlated band theories

Richard L. Martin, Gustavo E. Scuseria, J. Kunes, 2006, cond-mat/0605430.

Effect of intramolecular disorder and intermolecular electronic interactions on the electronic structure of poly-p-phenylene vinylene

Richard L. Martin, A. Saxena, Ping Yang, 2007, 0707.2002.

Effect of Fock exchange on the electronic structure and magnetic coupling in NiO

Richard L. Martin, F. Illas, I. P. R. Moreira, 2002 .

Spin-orbit splittings and energy band gaps calculated with the Heyd-Scuseria-Ernzerhof screened hybrid functional

Richard L. Martin, Gustavo E. Scuseria, Juan E. Peralta, 2006 .

Chemi-ionization of mercury atoms: Potential curves and estimates of the total ionization cross sections

Richard L. Martin, James S. Cohen, Lee A. Collins, 2002 .

NATURAL TRANSITION ORBITALS

Richard L. Martin, Enrique R. Batista, R. L. Martin, 2003 .

Theoretical studies of the structures and vibrational frequencies of actinide compounds using relativistic effective core potentials with Hartree–Fock and density functional methods: UF6, NpF6, and PuF6

Richard L. Martin, P. Jeffrey Hay, P. Hay, 1998 .

Ab initio quantum chemistry using the density matrix renormalization group

Richard L. Martin, Steven R. White, 1998 .

Trends in covalency for d- and f-element metallocene dichlorides identified using chlorine K-edge X-ray absorption spectroscopy and time-dependent density functional theory.

Ping Yang, Richard L. Martin, David L. Clark, 2009, Journal of the American Chemical Society.

Electron localization in the ground state of the ruthenium blue dimer.

Richard L. Martin, E. Batista, R. L. Martin, 2007, Journal of the American Chemical Society.

Covalency trends in group IV metallocene dichlorides. chlorine K-edge X-ray absorption spectroscopy and time dependent-density functional theory.

Richard L. Martin, Ping Yang, P. Hay, 2008, Inorganic chemistry.

Density functional calculations on actinide compounds: Survey of recent progress and application to [UO2X4]2− (X=F, Cl, OH) and AnF6 (An=U, Np, Pu)

Richard L. Martin, G. Schreckenbach, P. Hay, 1999 .

Application of Gradient-Corrected Density Functional Theory to the Structures and Thermochemistries of $\mbox{ScF}_3$, $\mbox{TiF}_4$, $\mbox{VF}_5$, and $\mbox{CrF}_6$

Richard L. Martin, T. Russo, P. Hay, 1995, chem-ph/9502008.

Theoretical studies of H2 desorption processes in chemical vapor deposition of boron-doped silicon surfaces

Richard L. Martin, J. Kress, P. Hay, 1999 .

Role of d and f orbitals in the geometries of low-valent actinide compounds. Ab initio studies of U(CH{sub 3}){sub 3}, Np(CH{sub 3}){sub 3}, and Pu(CH{sub 3}){sub 3}

Richard L. Martin, J. V. Ortiz, P. Hay, 1992 .

Energy-Degeneracy-Driven Covalency in Actinide Bonding.

Richard L. Martin, D. Shuh, G. Seidler, 2018, Journal of the American Chemical Society.

Computational Studies of Bonding and Reactivity in Actinide Molecular Complexes

Richard L. Martin, Ping Yang, E. Batista, 2015 .

New evidence for 5f covalency in actinocenes determined from carbon K-edge XAS and electronic structure theory

Richard L. Martin, T. Tyliszczak, D. Shuh, 2014 .

Theoretical Studies of the Properties and Solution Chemistry of AnO22+and AnO2+Aquo Complexes for An = U, Np, and Pu

Richard L. Martin, G. Schreckenbach, P. Hay, 2000 .

Determining relative f and d orbital contributions to M-Cl covalency in MCl6(2-) (M = Ti, Zr, Hf, U) and UOCl5(-) using Cl K-edge X-ray absorption spectroscopy and time-dependent density functional theory.

Richard L. Martin, D. Shuh, Ping Yang, 2012, Journal of the American Chemical Society.

Investigation of the role of triplet states in the Wulf bands of ozone

Richard L. Martin, P. Hay, M. Braunstein, 1995 .

The lowest excited 1A2 and 1B1 states of ozone: Two conical intersections and their impact on photodissociation

Richard L. Martin, R. T. Pack, P. Hay, 1991 .

Cluster studies of La2CuO4: CuO6

Richard L. Martin, P. Hay, R. L. Martin, 1993 .

AgH, Ag2, and AgO revisited: Basis set extensions

Richard L. Martin, 1987 .

All‐electron and valence‐electron calculations on AgH, Ag2, and AgO

Richard L. Martin, P. Hay, R. L. Martin, 1985 .

Electronic structure of self-assembled amorphous polyfluorenes.

Richard L. Martin, A. Saxena, Ping Yang, 2008, ACS nano.

Molecular geometry fluctuations and field-dependent mobility in conjugated polymers

Richard L. Martin, A. Saxena, Darryl L. Smith, 2001 .

Carbon K-edge X-ray absorption spectroscopy and time-dependent density functional theory examination of metal-carbon bonding in metallocene dichlorides.

Richard L. Martin, T. Tyliszczak, L. Vernon, 2013, Journal of the American Chemical Society.

Probing Ni[S2PR2]2 electronic structure to generate insight relevant to minor actinide extraction chemistry.

Richard L. Martin, B. Scott, J. Keith, 2012, Inorganic chemistry.

Nature of bonding in complexes containing "supershort" metal-metal bonds. raman and theoretical study of M2(dmp)4 [M = Cr (natural abundance Cr, 50Cr, and 54Cr) and Mo; dmp = 2,6-dimethoxyphenyl].

Richard L. Martin, J. L. Eglin, F. Cotton, 2010, Journal of the American Chemical Society.