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Turkish Computational and Theoretical Chemistry
Vol: 2 Issue: 2
Detemination of The Best Method (HF, MP2 and B3LYP) in Calculation of Chemical Hardness
Zinet ZAİM
,
Tuba ALAGÖZ SAYIN
,
Koray SAYIN
,
Duran KARAKAŞ
Publication date :
2018-12-15
Radiative transition probabilities for 3p63d2 and 3p53d3 transitions in W54+
Gülay GÜNDAY KONAN
,
Leyla ÖZDEMİR
Publication date :
2018-12-15
QSAR Studies of amino-pyrimidine derivatives as Mycobacterium tuberculosis Protein Kinase B inhibitors
Saida KHAMOULI
,
Salah BELAIDI
,
Houmam BELAIDI
,
Lotfi BELKHIRI
Publication date :
2018-12-15
New Organic Materials Based on Thiophene for Photovoltaic Device: Theoretical investigation
Mohammed BOUACHRINE
,
Tayeb ABRAM
,
Rachid KACİMİ
,
Lahcen BEJJİT
,
Mohammed NASSİRİ BENNANİ
Publication date :
2018-12-15
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
Publication date :
2018-12-15
Theoretical studies of structural, optic and electronic properties of polypyrrole (PPy) oligomer
Aslı KAYA
Publication date :
2018-12-15