Research Explorer

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Researcher

Kasun Kalhara Gunasooriya Govini Thanthrige

Awards & Distinctions

24 Results

2019

Modeling-guided design of catalytic processes

Kasun Kalhara Gunasooriya Govini Thanthrige

Operando computational catalysis : shape, structure, and coverage under reaction conditions

Jenoff De VriezeKasun Kalhara Gunasooriya Govini ThanthrigeJoris ThybautMark Saeys

A1 Journal Article in CURRENT OPINION IN CHEMICAL ENGINEERING

Theoretical study of the mechanism and microkinetics of cobalt-catalyzed Fischer-Tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark SaeysGuy Marin

2018

CO Adsorption on Pt(111) : from isolated molecules to ordered high–coverage structures

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

A1 Journal Article in ACS CATALYSIS

Reaction mechanism and microkinetics of the cobalt catalyzed Fischer–Tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

2017

CO adsorption on platinum and cobalt : site preference and coverage effects

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

Ethylene hydrogenation over Pt/TiO2 : a charge-sensitive reaction

Kasun Kalhara Gunasooriya Govini ThanthrigeEdmund G SeebauerMark Saeys

A2 Journal Article in ACS CATALYSIS

Hacking the CO2 cycle using computers

Kasun Kalhara Gunasooriya Govini Thanthrige

Hacking the Carbon cycle using computers

Kasun Kalhara Gunasooriya Govini Thanthrige

Modeling-Guided Design of Catalytic Processes

Kasun Kalhara Gunasooriya Govini Thanthrige

Reaction Mechanism and Microkinetics of the Cobalt Catalyzed Fischer–Tropsch Synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

Reaction Mechanisms in C1 Chemistry: Fischer-Tropsch Synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

2016

Catalyst structure and C-O activation during FTS : new ideas from computational catalysis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

Catalyst structure and C-O activation during Fischer-Tropsch Synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeA BanerjeeMark Saeys

Key role of surface hydroxyl groups in C−O activation during fischer−tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeA van BavelH KuipersMark Saeys

A1 Journal Article in ACS CATALYSIS

Role of Surface Hydroxyl Groups as hydrogenating species during Fischer-Tropsch Synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

Spontaneous formation of cobalt nano-islands and kinetic role of hydroxyl species during Fischer-Tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeA BanerjeeMark Saeys

Spontaneous formation of cobalt nano-islands and kinetic role of hydroxyl species during Fischer-Tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeA. BanerjeeMark Saeys

2015

CO adsorption on cobalt: prediction of stable surface phases

Kasun Kalhara Gunasooriya Govini ThanthrigeAP van BavelHPCE KuipersMark Saeys

A1 Journal Article in SURFACE SCIENCE

Computational Catalysis Under Reaction Conditions : Spontaneous Formation of Cobalt Nano-Islands and Kinetic Role of Hydroxyl Groups during Fischer Tropsch Synthesis

Mark SaeysKasun Kalhara Gunasooriya Govini Thanthrige

Controlling the activity of Pt/TiO2 by defect engineering of the TiO2 support

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

Modeling-guided design of catalytic processes

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys

New reaction paths and catalyst structures for an old reaction: fischer tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeJoris Thybaut

Reaction path analysis for CO hydrogenation during fischer tropsch synthesis

Kasun Kalhara Gunasooriya Govini ThanthrigeMark Saeys