EXTRACTION OF STRONTIUM(II)BY CROWN ETHER: INSIGHTS FROM DENSITY FUNCTIONAL CALCULATION
The structures, energetic and thermodynamic parameters of crown ethers with different cavity size, electron donating/withdrawing substituent groups and donor atoms have been determined with density functional method at B3L YP level of theory in gas and solvent phase. Small core quasi-relativistic ef...
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| Format: | Article NonPeerReviewed |
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[Yogyakarta] : Universitas Gadjah Mada
2012
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| Online Access: | https://repository.ugm.ac.id/29024/ http://i-lib.ugm.ac.id/jurnal/download.php?dataId=12087 |
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| Institution: | Universitas Gadjah Mada |