国家/地区 India（10）
关键词 DFT（10）
出版物
出版时间 2019（10）
机构
作者 SRIVASTAVA A（2）

Computational studies of anti-cancer drug mediated by graphene and reaction mechanism of drug generated alkyl radical with guanine

JOURNAL OF MOLECULAR STRUCTURE

BEGUM SS, GOUR NK, SONAVANE U, RAY SK, DEKA RC

Controlling the electronic properties of zigzag graphene nanoribbon using amino acids and oxygen molecule-A first principles DFT study

APPLIED SURFACE SCIENCE

KUMAR J, MOHANRAJ HR, CHRISTIAN PK, DAVID JT

Quantum capacitance tuned flexible supercapacitor by UV-ozone treated defect engineered reduced graphene oxide forest

NANOTECHNOLOGY

RAHA H, MANNA B, PRADHAN D, GUHA PK

A computational study of structural, electronic and carrier mobility of boron and phosphorus/nitrogen co-doped graphene

PHYSICA BCONDENSED MATTER

YADAV VK, MIR SH, SINGH JK

Vibrational and thermodynamic properties of pure and gold adsorbed graphene

VACUUM

KAUR G, MANN S, GUPTA S, DHARAMVIR K

Adsorption of Bromonitromethane over Graphene-Based Substrates: A Density Functional Theory Analysis

CHEMISTRYSELECT

MANDEEP, SHARMA L, KAKKAR R

Bulk synthesis of graphene nanosheets from plastic waste: An invincible method of solid waste management for better tomorrow

WASTE MANAGEMENT

PANDEY S, KARAKOTI M, DHALI S, KARKI N, SANTHIBHUSHAN B, TEWARI C, RANA S, SRIVASTAVA A, MELKANI AB, SAHOO NG

Inducing dye-selectivity in graphene oxide for cationic dye separation applications

MATERIALS CHEMISTRY PHYSICS

RANJAN P, VERMA P, AGRAWAL S, RAO TR, SAMANTA SK, THAKUR AD

Defected Graphene as Ammonia Sensor: Theoretical Insight

IEEE SENSORS JOURNAL

DANDELIYA S, SRIVASTAVA A

Anion center dot center dot center dot pi interaction in oxoanion-graphene complex using coronene as model system: A DFT study

COMPUTATIONAL THEORETICAL CHEMISTRY

SAHA B, BHATTACHARYYA PK