国家/地区 India（12）
关键词 DENSITY FUNCTIONAL .（2）
出版物 JOURNAL OF PHYSICAL.（3） APPLIED SURFACE SCI.（2） PHYSICAL CHEMISTRY .（2）
出版时间 2021（3） 2023（2）
机构 CSIR NATL CH.（2）
作者 KRISHNAMURTY S（12）

Unravelling the distinct surface interactions of modified graphene nanostructures with methylene blue dye through experimental and computational approaches

JOURNAL OF HAZARDOUS MATERIALS

MANAPPADAN Z, KUMAR S, JOSHI K, GOVINDARAJA T, KRISHNAMURTY S, SELVARAJ K

Dinitrogen Activation on Graphene Anchored Single Atom Catalysts: Local Site Activity or Surface Phenomena

JOURNAL OF PHYSICAL CHEMISTRY C

MAIBAM A, GOVINDARAJA T, SELVARAJ K, KRISHNAMURTY S

Dissociative chemisorption of hydrogen molecules on defective graphene-supported aluminium clusters: a computational study

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

KUMAR D, GOVINDARAJA T, KRISHNAMURTY S, KALIAPERUMAL S, PAL S

Discerning Site Selectivity on Graphene Nanoflakes Using Conceptual Density Functional Theory Based Reactivity Descriptors

JOURNAL OF PHYSICAL CHEMISTRY C

NAZRULLA MA, KRISHNAMURTY S, PHANI KLN

Dissociative Adsorption of Molecular Hydrogen on BN-Doped Graphene-Supported Aluminum Clusters

JOURNAL OF PHYSICAL CHEMISTRY C

KUMAR D, KRISHNAMURTY S, PAL S

N-2 activation on Al metal clusters: catalyzing role of BN-doped graphene support

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

KUMAR D, PAL S, KRISHNAMURTY S

Chemically modified graphene sheets as potential sensors for organophosphate compounds(pesticide): A DFT study

APPLIED SURFACE SCIENCE

SHIVANKAR BR, SINGH CP, KRISHNAMURTY S

Synergetic storage of ammonia over Al quantum dots embedded graphene sheets: A first principles perspective

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

SINGH CP, KRISHNAMURTY S

Substrate augmented catalytic activity towards NRR: A case study of Li doped Al clusters on defective graphene

APPLIED SURFACE SCIENCE

SAMAL PP, POONAM, KRISHNAMURTY S

Nitrogen activation to reduction on a recyclable V-SAC/BN-graphene heterocatalyst sifted through dual and multiphilic descriptors

JOURNAL OF COLLOID INTERFACE SCIENCE

MAIBAM A, KRISHNAMURTY S