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A DFT study on dihydropyrazine annulated linear polyacenes: aromaticity, stability and HOMO-LUMO energy modulation

A DFT study on dihydropyrazine annulated linear polyacenes: aromaticity, stability and HOMO-LUMO energy modulation

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Rakhi, R; Suresh, CH
  • Volume :
  • Year : 2016
Quantification and classification of substituent effects in organic chemistry: a theoretical molecular electrostatic potential study

Quantification and classification of substituent effects in organic chemistry: a theoretical molecular electrostatic potential study

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Remya, GS; Suresh, CH
  • Volume :
  • Year : 2016
Effect of the electric field during annealing of organic light emitting diodes for improving its on/off ratio

Effect of the electric field during annealing of organic light emitting diodes for improving its on/off ratio

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Sharma, RK; Katiyar, M; Rao, IVK; Unni, KNN; Deepak
  • Volume :
  • Year : 2016
Observation of short range ferromagnetic interactions and magnetocaloric effect in cobalt substituted Gd5Si2Ge2

Observation of short range ferromagnetic interactions and magnetocaloric effect in cobalt substituted Gd5Si2Ge2

  • --- Research Area : Materials Science & Technology Division (MSTD)
  • Author : Uthaman, B; Manju, P; Thomas, S; Nagar, DJ; Suresh, KG; Varma, MR
  • Volume :
  • Year : 2017
Surface modification induced enhanced CO2 sorption in cucurbit[6]uril, an organic porous material

Surface modification induced enhanced CO2 sorption in cucurbit[6]uril, an organic porous material

  • --- Research Area : Materials Science & Technology Division (MSTD)
  • Author : Mohan, M; Suzuki, T; Nair, AK; Pillai, S; Warrier, KGK; Hareesh, US; Nair, BN; Gale, JD
  • Volume :
  • Year : 2017
Influence of local structure on photoluminescence properties of Eu3+ doped CeO2 red phosphors through induced oxygen vacancies by contrasting rare earth substitutions

Influence of local structure on photoluminescence properties of Eu3+ doped CeO2 red phosphors through induced oxygen vacancies by contrasting rare earth substitutions

  • --- Research Area : Materials Science & Technology Division (MSTD)
  • Author : Raj, AKV; Rao, PP; Sreena, TS; Thara, TRA
  • Volume :
  • Year : 2017
Massive dihydrogen uptake by anionic carbon chains

Massive dihydrogen uptake by anionic carbon chains

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Della, TD; Suresh, CH
  • Volume :
  • Year : 2017
The remarkable ability of anions to bind dihydrogen

The remarkable ability of anions to bind dihydrogen

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Della, TD; Suresh, CH
  • Volume :
  • Year : 2016
Sumanene: an efficient pi-bowl for dihydrogen storage

Sumanene: an efficient pi-bowl for dihydrogen storage

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Della, TD; Suresh, CH
  • Volume :
  • Year : 2018
Anion-encapsulating fullerenes behave as large anions: a DFT study

Anion-encapsulating fullerenes behave as large anions: a DFT study

  • --- Research Area : Chemical Sciences & Technology Division (CSTD)
  • Author : Della, TD; Suresh, CH
  • Volume :
  • Year : 2018