Modeling the metal-semiconductor interaction: Analytical bond-order potential for platinum-carbon (original) (raw)

Density functional theory study of bulk platinum monoxide

Jamal Udin

Physical Review B, 2005

View PDFchevron_right

Structures and electronic properties of platinum nitride by density functional theory

jamal udin

Physical Review B, 2005

View PDFchevron_right

Chemical bonding, elasticity, and valence force field models: A case study for α-Pt_ {2} Si and PtSi

Oliver Beckstein

2001

View PDFchevron_right

Theoretical Study of Pt(PR 3 ) 2 (AlCl 3 ) (R = H, Me, Ph, or Cy) Including an Unsupported Bond between Transition Metal and Non-transition Metal Elements: Geometry, Bond Strength, and Prediction

Shinya Tsukamoto

The Journal of Physical Chemistry A, 2011

View PDFchevron_right

Density functional studies of the electronic and geometric structures of Pt3+, Pt3O+, Pt3O2+ and Pt3CH4+

Djamaladdin Musaev

Journal of Molecular Structure: THEOCHEM, 2002

View PDFchevron_right

Comparative study of ab initio and tight-binding electronic structure calculations applied to platinum surfaces

N. Bernstein, Cyrille Barreteau

Physical Review B, 2004

View PDFchevron_right

On the nature of hydrogen bonds to platinum(ii) – which interaction can predict their strength?

Rocío Sánchez

Physical Chemistry Chemical Physics, 2015

View PDFchevron_right

High resolution transmission electron microscopy and electronic structure theory investigation of platinum nanoparticles on carbon black

Corentin Poidevin

The Journal of Chemical Physics

View PDFchevron_right

Electronic band structure of platinum low--index surfaces: an {\it ab initio} and tight--binding study. II

Hernan Javier Herrera Suarez

2010

View PDFchevron_right

Comparative study ofab initioand tight-binding electronic structure calculations applied to platinum surfaces

Cyrille Barreteau

Physical Review B, 2004

View PDFchevron_right

Structural and electronic properties of the Pt n–PAH complex (n= 1, 2) from density functional calculations

Mehdi Mahmoodinia, Mahsa Ebadi

View PDFchevron_right

Extended embedded-atom method for platinum nanoparticles

Kyeongjae Cho

Surface Science, 2006

View PDFchevron_right

First-principles study of CO bonding to Pt(111): validity of the Blyholder model

Shinji TSUNEYUKI

Surface Science, 1998

View PDFchevron_right

Comprehensive relativisticab initio and density functional theory studies on PtH, PtF, PtCl, and Pt(NH3)2Cl2

Wenjian Liu

Journal of Computational Chemistry, 2002

View PDFchevron_right

Nature of the Metal−Alkene Bond in Platinum Complexes of Strained Olefins

jamal udin

Organometallics, 1999

View PDFchevron_right

Density Functional Theory Calculations on the Interaction of Ethene with the {111} Surface of Platinum

David Willock

The Journal of Physical Chemistry B, 2000

View PDFchevron_right

Molecular-orbital calculations on Pt2, PtH and PtCO with an optimized relativistic pseudopotential for Pt

Gian Franco Tantardini

Chemical Physics Letters, 1986

View PDFchevron_right

Magnus' Green Salt Revisited: Impact of Platinum–Platinum Interactions on Electronic Structure and Carrier Mobilities

T. Kreouzis

Advanced Materials, 2006

View PDFchevron_right

Theoretical study of electronic states of platinum pentamer (Pt[sub 5])

D. Majumdar

The Journal of Chemical Physics, 2000

View PDFchevron_right

Density functional calculations on small platinum clusters: Ptnq (n=1–4, q=0,±1)

Alessandro Fortunelli

Journal of Molecular Structure: THEOCHEM, 1999

View PDFchevron_right

Interaction of a CO molecule with a Pt monoatomic chain: the top geometry

Andrea Corso

2008

View PDFchevron_right

Structural stabilities and band structure characteristics of platinum nitride (PtN) via first-principles calculations

Mohammed Abu-Jafar

Chinese Journal of Physics, 2017

View PDFchevron_right

Study of the chemical dependence of the effective pair potentials of Co–Pt alloy

pierre cenedese

Journal of Applied Crystallography, 1999

View PDFchevron_right

Size dependence of the lattice parameters of carbon supported platinum nanoparticles: X-ray diffraction analysis and theoretical considerations

I. Leontyev

RSC Advances, 2014

View PDFchevron_right

Tuning the Metal-Adsorbate Chemical Bond through the Ligand Effect on Platinum Subsurface Alloys

Dennis Nordlund

Angewandte Chemie International Edition, 2012

View PDFchevron_right

Di-metallated platinum carbonyl complexes: platinum–platinum interactions in the solid state

Jonathan Rourke

Journal of the Chemical Society, Dalton Transactions, 2001

View PDFchevron_right

Influence of Carbon Support on Electronic Structure and Catalytic Activity of Pt Catalysts: Binding to the CO Molecule

Per-Olof Åstrand

The Journal of Physical Chemistry C, 2016

View PDFchevron_right