Journals / Turkish Computational and Theoretical Chemistry
Turkish Computational and Theoretical Chemistry
Turkish Computational and Theoretical Chemistry
Turkish Computational and Theoretical Chemistry will publish three issues a year as of 2023 (in January, May and September). Please send your CV to [email protected] to become a referee and editor in our journal Please click to see the forthcoming issue.
2018 · Cilt: 2 - Sayı: 2
| Article | Author | Pages |
|---|---|---|
| Radiative transition probabilities for 3p63d2 and 3p53d3 transitions in W54+ | Gülay GÜNDAY KONAN, Leyla ÖZDEMİR | 1–6 |
| Detemination of The Best Method (HF, MP2 and B3LYP) in Calculation of Chemical Hardness | Zinet ZAİM, Tuba ALAGÖZ SAYIN, Koray SAYIN, Duran KARAKAŞ | 7–15 |
| QSAR Studies of amino-pyrimidine derivatives as Mycobacterium tuberculosis Protein Kinase B inhibitors | Saida KHAMOULI, Salah BELAIDI, Houmam BELAIDI, Lotfi BELKHIRI | 16–27 |
| Formation of 3-buten-1-ol over metal encapsulated ZSM-5 from formaldehyde and propene: A Density Functional Theory study | Tamilmani SELVARAJ, Renganathan RAJALİNGAM, Viswanathan BALASUBRAMANİAN | 28–35 |
| New Organic Materials Based on Thiophene for Photovoltaic Device: Theoretical investigation | Mohammed BOUACHRINE, Tayeb ABRAM, Rachid KACİMİ, Lahcen BEJJİT, Mohammed NASSİRİ BENNANİ | 36–48 |
| Theoretical studies of structural, optic and electronic properties of polypyrrole (PPy) oligomer | Aslı KAYA | 49–56 |