国家/地区 India（24）
关键词 DFT（11） GRAPHENE（7） ADSORPTION（5）
DOPING（3） ORR（3） ANODE（2）
BAND STRUCTURE（2） DENSITY FUNCTIONAL .（2） DESCRIPTOR（2）
ELECTROCATALYST（2） HETEROSTRUCTURE（2） INTERFACE（2）
METALFREE CATALYST（2） OXYGEN REDUCTION RE.（2） TRANSPORT（2）
出版物 NANOSCALE（3） CATALYSIS TODAY（2） INTERNATIONAL JOURN.（2）
JOURNAL OF MATERIAL.（2）
出版时间 2014（3） 2015（3） 2016（3） 2017（3） 2018（3） 2021（3） 2022（2） 2023（2）
机构 JADAVPUR UNI.（8） SRM UNIV（5） INDIAN ASSOC.（4）
作者 THAPA R（25）

Charge transfer induced ferromagnetism and anomalous temperature increment of coercivity in ultrathin -Fe2O3 decorated graphene 2D nanostructures

JOURNAL OF APPLIED PHYSICS

BHATTACHARYA S, DINDA D, KUMAR EM, THAPA R, SAHA SK

Resonant energy transfer in a van der Waats stacked MoS2 - functionalized graphene quantum dot composite with ab initio vatidation

NANOSCALE

ROY R, THAPA R, BISWAS S, SAHA S, GHORAI UK, SEN D, KUMAR EM, KUMAR GS, MAZUMDER N, ROY D, CHATTOPADHYAY KK

Origin of spin polarization in an edge boron doped zigzag graphene nanoribbon: a potential spin filter

NANOTECHNOLOGY

CHAKRABARTY S, WASEY AHMA, THAPA R, DAS GP

Structural and Electronic Descriptors of Catalytic Activity of Graphene-Based Materials: First-Principles Theoretical Analysis

SMALL

SINTHIKA S, WAGHMARE UV, THAPA R

A first-principles investigation of oxygen reduction reaction catalysis capabilities of As decorated defect graphene

DALTON TRANSACTIONS

SEN D, THAPA R, CHATTOPADHYAY KK

Rules of Boron-Nitrogen Doping in Defect Graphene Sheets: A First-Principles Investigation of Band-Gap Tuning and Oxygen Reduction Reaction Catalysis Capabilities

CHEMPHYSCHEM

SEN D, THAPA R, CHATTOPADHYAY KK

Amino-functionalized graphene quantum dots: origin of tunable heterogeneous photoluminescence

NANOSCALE

KUMAR GS, ROY R, SEN D, GHORAI UK, THAPA R, MAZUMDER N, SAHA S, CHATTOPADHYAY KK

Small Pd cluster adsorbed double vacancy defect graphene sheet for hydrogen storage: A first-principles study

INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

SEN D, THAPA R, CHATTOPADHYAY KK

Palladium atoms and its dimers adsorbed on graphene: First-principles study

PHYSICA BCONDENSED MATTER

THAPA R, SEN D, MITRA MK, CHATTOPADHYAY KK

Role of oxygen functionality on the band structure evolution and conductance of reduced graphene oxide

CHEMICAL PHYSICS LETTERS

ROY R, THAPA R, CHAKRABARTY S, JHA A, MIDYA PR, KUMAR EM, CHATTOPADHYAY KK