List of works - Tapio T Rantala

A density functional study on dielectric properties of acrylic acid grafted polypropylene

scientific article published on 01 April 2011

Ab initiodescription of photoabsorption and electron transfer in a doubly-linked porphyrin-fullerene dyad

Anomalous Bismuth-Stabilized (2×1) Reconstructions on GaAs(100) and InP(100) Surfaces

scientific article published in Physical Review Letters

Comment on ‘‘Effect of surface reconstruction on stability and reactivity of Si clusters’’

scientific article published in Physical Review Letters

Coverage dependence of finite temperature quantum distribution of hydrogen on nickel(001) surface

scientific article published in March 2007

DFT and TDDFT Study Related to Electron Transfer in Nonbonded Porphine···C60Complexes

article

Effects of orientation at the phthalocyanine–CdSe interface on the electron transfer characteristics

scientific article published on 01 April 2017

Effects of repulsion and dispersion forces in liquid crystals: Alignment and deformation ofH2solute

article

Effects of two double bonds on the hydrocarbon interior of a phospholipid bilayer

Electron spin resonance parameters of bulk oxygen vacancy in semiconducting tin dioxide

scholarly article in Physical Review B, vol. 81 no. 23, June 2010

Electronic and structural properties of Si10 cluster

Electronic damping of adsorbate motion: CO vibration on the Cu(100) surface

article

Electronic structure of p-type perylene monoimide-based donor-acceptor dyes on the nickel oxide (100) surface: a DFT approach.

scientific article published in May 2016

Exact modeling of finite temperature and quantum delocalization effects on reliability of quantum-dot cellular automata

Finite temperature quantum distribution of hydrogen adsorbate on nickel (001) surface

scientific article published in May 2006

Finite temperature quantum statistics of H3+ molecular ion

scientific article published on 28 July 2010

Finite-Temperature Effects on Correlation of Electrons in Quantum Dots

First-principles simulation of molecular dissociation–recombination equilibrium

article

Inequivalence of single CHa and CHb methylene bonds in the interior of a diunsaturated lipid bilayer from a molecular dynamics simulation

article

Models for thermal dissociation of silane on a polysilicon surface

Molecular simulations for the conformational assessment of a porphyrin–fullerene dyad in different environments

article

Numerical Path Integral Approach to Quantum Dynamics and Stationary Quantum States

scientific article published in July 2015

Path integrals: From quantum mechanics to photonics

scientific article published in 2021

Porphyrin adsorbed on the (101[combining macron]0) surface of the wurtzite structure of ZnO--conformation induced effects on the electron transfer characteristics

scientific article published in October 2013

Potential energy curves for diatomic molecules calculated with numerical basis functions

Solution of atomic orbitals in an interpolating wavelet basis

scientific article published on 2 December 2004

Solution structure of nodularin. An inhibitor of serine/threonine-specific protein phosphatases

scientific article

Static field-gradient polarizabilities of small atoms and molecules at finite temperature.

scientific article published in November 2017

Structure and dynamic properties of diunsaturated 1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphatidylcholine lipid bilayer from molecular dynamics simulation

scientific article published in December 1997

Surface relaxation of the (100) face of wurtzite CdS

TD-DFT Description of Photoabsorption and Electron Transfer in a Covalently Bonded Porphyrin−Fullerene Dyad

scientific article published on 01 November 2006

Thermal desorption of molecular oxygen from SnO 2 (110) surface: Insights from first-principles calculations

article published in 2016

Xe129 adsorbed in AlPO4-11 molecular sieve: Molecular dynamics simulation of adsorbate dynamics and NMR chemical shift

article

List of works by Tapio T Rantala

A density functional study on dielectric properties of acrylic acid grafted polypropylene

Ab initiodescription of photoabsorption and electron transfer in a doubly-linked porphyrin-fullerene dyad

Anomalous Bismuth-Stabilized (2×1) Reconstructions on GaAs(100) and InP(100) Surfaces

Comment on ‘‘Effect of surface reconstruction on stability and reactivity of Si clusters’’

Coverage dependence of finite temperature quantum distribution of hydrogen on nickel(001) surface

DFT and TDDFT Study Related to Electron Transfer in Nonbonded Porphine···C60Complexes

Effects of orientation at the phthalocyanine–CdSe interface on the electron transfer characteristics

Effects of repulsion and dispersion forces in liquid crystals: Alignment and deformation ofH2solute

Effects of two double bonds on the hydrocarbon interior of a phospholipid bilayer

Electron spin resonance parameters of bulk oxygen vacancy in semiconducting tin dioxide

Electronic and structural properties of Si10 cluster

Electronic damping of adsorbate motion: CO vibration on the Cu(100) surface

Electronic structure of p-type perylene monoimide-based donor-acceptor dyes on the nickel oxide (100) surface: a DFT approach.

Exact modeling of finite temperature and quantum delocalization effects on reliability of quantum-dot cellular automata

Finite temperature quantum distribution of hydrogen adsorbate on nickel (001) surface

Finite temperature quantum statistics of H3+ molecular ion

Finite-Temperature Effects on Correlation of Electrons in Quantum Dots

First-principles simulation of molecular dissociation–recombination equilibrium

Inequivalence of single CHa and CHb methylene bonds in the interior of a diunsaturated lipid bilayer from a molecular dynamics simulation

Models for thermal dissociation of silane on a polysilicon surface

Molecular simulations for the conformational assessment of a porphyrin–fullerene dyad in different environments

Numerical Path Integral Approach to Quantum Dynamics and Stationary Quantum States

Path integrals: From quantum mechanics to photonics

Porphyrin adsorbed on the (101[combining macron]0) surface of the wurtzite structure of ZnO--conformation induced effects on the electron transfer characteristics

Potential energy curves for diatomic molecules calculated with numerical basis functions

Solution of atomic orbitals in an interpolating wavelet basis

Solution structure of nodularin. An inhibitor of serine/threonine-specific protein phosphatases

Static field-gradient polarizabilities of small atoms and molecules at finite temperature.

Structure and dynamic properties of diunsaturated 1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphatidylcholine lipid bilayer from molecular dynamics simulation

Surface relaxation of the (100) face of wurtzite CdS

TD-DFT Description of Photoabsorption and Electron Transfer in a Covalently Bonded Porphyrin−Fullerene Dyad

Thermal desorption of molecular oxygen from SnO 2 (110) surface: Insights from first-principles calculations

Xe129 adsorbed in AlPO4-11 molecular sieve: Molecular dynamics simulation of adsorbate dynamics and NMR chemical shift