Keywords = HOMO-LUMO gap
Number of Articles: 2
1. Investigation of Structural and Optoelectronic Properties of Sc2O3 Nanoclusters: A DFT Study

Volume 6, Issue 3, Summer 2018, Pages 493-504

Saeideh Hosseini; Morteza Vahedpour; Maryam Shaterian; Mohammad Ali Rezvani

Investigation of Structural and Optoelectronic Properties of Sc2O3 Nanoclusters: A DFT Study


2. Comparative Computational Studies of 1,4-Diformyl-piperazine and 1,4-Dithionyl-Piperazine

Volume 6, Issue 2, Spring 2018, Pages 263-285

Fatima Yahia Cherif; Okkacha Bensaid; Asmaa Mostefai; Ali Rahmouni

Comparative Computational Studies of 1,4-Diformyl-piperazine and 1,4-Dithionyl-Piperazine