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Density Functional Study on Benzene, Toluene, Ethylbenzene and Xylene Adsorptions on ZnO(100) Surface
Article info application/pdf Journal
oleh Nugraha, Nugraha, Saputro, Adhitya Gandaryus, Agusta, Mohammad Kemal, Akbar, Fiki Taufik, Pramudya, Aditya Dimas
Terbitan: Universitas Jenderal Soedirman, 2019
Institusi: Universitas Jenderal Soedirman
Gedung: Fakultas Matematika dan Ilmu Pengetahuan Alam
Lokasi Repository IOS Number
PURWOKERTOMolekulIOS4652.article-501
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Studi Komputasi Metode Ab Initio Dft Dalam Kajian Struktural Dan Sifat Elektronik Senyawa Kalsium Borohidrid-Diamonia Sebagai Penyimpan Hidrogen
Article info application/pdf eJournal
oleh Kurniawan, Muhammad Arsyik
Terbitan: Fakultas Matematika dan Ilmu Pengetahuan Alam, 2016
Lokasi Repository IOS Number
SLEMANJurnal EksaktaIOS1363.article-4378
SLEMANJurnal El Tarbawi (Jurnal Pendidikan Islam)IOS1365.article-4378
SLEMANJurnal Universitas Islam IndonesiaIOS4863.article-4378
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The Explosive Sensitivity on the Complex Formation of 3-Nitro-1,2,4-Triazol-5-One and Metal Ions Based on Density Functional Study
Article application/pdf eJournal
oleh Saprizal Hadisaputra; Chemistry Education Division, Faculty of Teacher Training and Science Education, Universitas Mataram, Mataram 83125, Niko Prasetyo; Austrian-Indonesian Centre for Computational Chemistry, Department of Chemistry, Universitas Gadjah Mada, Sekip Utara Yogyakarta 55281
Terbitan: Directorate of Research and Community Engagement, Universitas Indonesia, 2016
Institusi: Universitas Indonesia
Gedung: Perpustakaan Universitas Indonesia
Lokasi Repository IOS Number
KOTA DEPOKMAKARA of Science SeriesIOS2206.article-5951
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Figure 2 from: Susi T (2015) Heteroatom quantum corrals and nanoplasmonics in graphene (HeQuCoG). Research Ideas and Outcomes 1: e7479. https://doi.org/10.3897/rio.1.e7479
info Image Journal
oleh Susi, Toma
Terbitan: 2015
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.976707
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Figure 1 from: Susi T (2015) Heteroatom quantum corrals and nanoplasmonics in graphene (HeQuCoG). Research Ideas and Outcomes 1: e7479. https://doi.org/10.3897/rio.1.e7479
info Image Journal
oleh Susi, Toma
Terbitan: 2015
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.976705
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Vibrational mode analysis studies on the configuration and structure stability for the subcarbonyl Fe(CO)n (n = 1-5)
Article Journal
oleh Hui Fu, Wen-juan Wang, Zhi Qiang Hou, Yan-li Tan, Xin-ming Zhou, Zheng-yu Zhou
Terbitan: 2012
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.5752391
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Understanding the Behavior of Fully Non-Toxic Polypyrrole-Gelatin and Polypyrrole-PVdF Soft Actuators with Choline Ionic Liquids
Article Journal
oleh Elhi, Fred, Karu, Karl, Rinne, Pille, Nadel, Kadi-Anne, Järvekülg, Martin, Aabloo, Alvo, Tamm, Tarmo, Ivaništšev, Vladislav, Põhako-Esko, Kaija
Terbitan: 2020
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.4737457
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Theoretical studies on the vibrational spectra, detonation properties, and stabilities for adamantyl nitrates
Article Journal
oleh Peng Lian, Wei-peng Lai, Xi-jie Wang, Bo-zhou Wang
Terbitan: 2015
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.5607222
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Dirhenium paddlewheel complexes bearing para-substituted triphenylguanidinate ligands : Synthesis, spectroscopic and computational studies
Article Journal
oleh Suman Mallick, Mrinal Kanti Ghosh, Anikul Islam, Swarup Chattopadhyay
Terbitan: 2015
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.5599808
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THEORETICAL INVESTIGATIONS ON MOLECULAR STRUCTURE, HOMO, LUMO, NBO ANALYSIS AND HYPERPOLARIZABILITY CALCULATIONS OF MONO AND EXTENDED-TETRATHIAFULVALENES (MONO/EX-TTFS)
Article Journal
oleh Tahar Abbaz*, Amel Bendjeddou and Didier Villemin
Terbitan: 2018
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.1218663
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bromate incorporation in calcium carbonates - density functional theory data
info dataset Journal
oleh Grau-Crespo, Ricardo, Fleitmann, Dominik, Midgley, Scott D.
Terbitan: 2021
Institusi: ZAIN Publications
Gedung: Cognizance Journal of Multidisciplinary Studies
Lokasi Repository IOS Number
StockholmCognizance Journal of Multidisciplinary StudiesIOS16997.5035293
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Heteroatom quantum corrals and nanoplasmonics in graphene (HeQuCoG)
Article
oleh Susi, Toma
Terbitan: 2015
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.575790
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Materials Simulation Toolkit (MAST) v2.0.0
info software
oleh MAST Development Team, University of Wisconsin-Madison Computational Materials Group
Terbitan: 2017
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.546138
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Ab Initio Molecular Dynamics Simulations of Furfural at the Liquid-Solid Interface
Article
oleh Sanwu Wang, Hongli Dang, Wenhua Xue, Darwin Shields, Xin Liu, Friederike C. Jentoft, Daniel E. Resasco
Terbitan: 2013
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.1087023
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XRD raw data for synthesis of Zr3Al1-xSixC2 MAX phases
info dataset
oleh Zapata-Solvas, Eugenio, Lee, Bill
Terbitan: 2017
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.264285
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Supplementary Material: Computational Study of Quasi-2D Liquid State in Free Standing Platinum, Silver, Gold, and Copper Monolayers
info Video
oleh Yang, Li-Ming, Ganz, Ariel B., Dornfeld, Matthew, Ganz, Eric
Terbitan: 2016
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.46838
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Computational data for selection of PBE+50HFX functional for studying Ru-Cl/H-PR3 complexes
info dataset
oleh Robert K Szilagyi, Savio Poovathingal, Timothy K Minton
Terbitan: 2018
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.1317590
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Computational data for selection of PBE+50HFX functional for studying Ru-Cl/H-PR3 complexes
info dataset
oleh Robert K Szilagyi, Savio Poovathingal, Timothy K Minton
Terbitan: 2018
Lokasi Repository IOS Number
KOTA PALEMBANGMarga Life in South Sumatra in the Past: Puyang Concept Sacrificed and DemythosizedIOS17403.1478258
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The Explosive Sensitivity on the Complex Formation of 3-Nitro-1,2,4-Triazol-5-One and Metal Ions Based on Density Functional Study
Book application/pdf Journal
oleh Hadisaputra, Saprizal, Prasetyo, Niko
Terbitan: UI Scholars Hub, 2016
Lokasi Repository IOS Number
KOTA DEPOKJournal of Materials Exploration and Findings (JMEF)IOS17654.science-1076
JAKARTA PUSATIndonesian Journal of Medical Chemistry and BioinformaticsIOS17919.science-1076
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DFT-based Study of Electric Field Effect on the Polarizability of Three Ringed Nematic Liquid Crystal Molecules
Book application/pdf Journal
oleh Upadhyay, Pranav, Mishra, Mirtunjai, Trivedi, Ankur, Kumar, Jitendra, Kumar, Asheesh, Kumar, Devesh
Terbitan: UI Scholars Hub, 2020
Lokasi Repository IOS Number
KOTA DEPOKJournal of Materials Exploration and Findings (JMEF)IOS17654.science-1179
JAKARTA PUSATIndonesian Journal of Medical Chemistry and BioinformaticsIOS17919.science-1179
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Topik: density functional theory
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18 Library Special 9 University 9
Institusi
17 Universitas PGRI Palembang 13 DEFAULT 8 ZAIN Publications 3 Institut Teknologi Bandung 3 Universitas Indonesia 2 Fakultas Kedokteran Universitas Indonesia more ... 1 Kementerian Perindustrian Republik Indonesia 1 Universitas Islam Indonesia 1 Universitas Jenderal Soedirman less ...
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Puyang Concept Sacrificed and Demythosized 17 13 DEFAULT 8 Cognizance Journal of Multidisciplinary Studies 3 Journal of Mathematical and Fundamental Sciences 2 Indonesian Journal of Medical Chemistry and Bioinformatics 2 Journal of Materials Exploration and Findings (JMEF) more ... 1 Journal of Industrial Research (Jurnal Riset Industri) 1 Jurnal Eksakta 1 Jurnal El Tarbawi (Jurnal Pendidikan Islam) 1 Jurnal Universitas Islam Indonesia 1 MAKARA of Science Series 1 Molekul less ...
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density functional theory 3 DFT 3 ab initio wave function 3 adsorption 3 atomic manipulation 3 basis set saturation limit more ... 3 chloro 3 electron energy loss spectroscopy 3 homogeneous complex speciation 3 hydrido 3 ion implantation 3 molecular dynamics 3 phosphino ligands 3 reactive-atom scattering 3 ruthenium complexes 3 scanning transmission electron microscopy 2 TB model 2 anthralin 2 carbon nanotubes 2 computational modeling 2 dithranol 2 explosive 2 free energy calculation 2 graphene nanoribbons 2 linear correlation coefficient 2 maximum likelihood 2 nanoribbons 2 nanotubes 2 optical absorption 2 polarizable solvation model 2 polypyrrole 2 sensitivity 2 spontaneous oxidation 2 tight-binding model 1 2-D liquid 1 2-D melting 1 Ab initio molecular dynamics simulations 1 Atomic 1 Condensed Matter Physics 1 CuI@[PMMA-co-MI] nanocatalyst 1 Detonation properties 1 Dirhenium 1 FTIR 1 Fe 1 Fe-S clusters 1 FeFe-hydrogenase 1 HydF maturase enzyme 1 MAST 1 MAX phases 1 MOF less ...
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6 Robert K Szilagyi 3 Savio Poovathingal 3 Susi, Toma 3 Timothy K Minton 2 Agusta, Mohammad Kemal 2 Saputro, Adhitya Gandaryus more ... 2 Vasil Saroka 1 Aabloo, Alvo 1 Abdelhady, Ahmed L. 1 Abrori, Syauqi Abdurrahman 1 Adiperdana, Budi 1 Ahmadi, S. 1 Akbar, Fiki Taufik 1 Akkerman, Quinten 1 Almaz Gazizov 1 Anikul Islam 1 Baranov, Dmitry 1 Bianchini, Paolo 1 Bo-zhou Wang 1 Budi, Eko Mursito; 1Laboratory of Computational Material Design and Quantum Engineering, Engineering Physics Research Group, Faculty of Industrial Technology, Institut Teknologi Bandung, Indonesia 1 Daniel E. Resasco 1 Darwin Shields 1 David, Melanie Y.; 2Division of Precision Science & Technology, and Applied Physics, Osaka University, Japan 3Physics Department, College of Science, De La Salle University, Malate, Manila, Philippines 1 Dipojono, Hermawan K.; 1Laboratory of Computational Material Design and Quantum Engineering, Engineering Physics Research Group, Faculty of Industrial Technology, Institut Teknologi Bandung, Indonesia 1 Dipojono, Hermawan Kresno 1 Dornfeld, Matthew 1 Elhi, Fred 1 Fathurrahman, Fadjar 1 Fleitmann, Dominik 1 Friederike C. Jentoft 1 Ganz, Ariel B. 1 Ganz, Eric 1 Goldoni, Luca 1 Grau-Crespo, Ricardo 1 Hadisaputra, Saprizal 1 Hartati, Yeni Wahyuni 1 Hongli Dang 1 Hosseinnejad, T. 1 Hui Fu 1 Ijaz, Palvasha 1 Imran, Muhammad 1 Infante, Ivan 1 Ivaništšev, Vladislav 1 Järvekülg, Martin 1 Karu, Karl 1 Kasai, Hideaki; 2Division of Precision Science & Technology, and Applied Physics, Osaka University, Japan 1 Kumar, Asheesh 1 Kumar, Devesh 1 Kumar, Jitendra 1 Kurniawan S, Muhammad Arsyik less ...
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2 Institute for Research and Community Services (LPPM) ITB 2 UI Scholars Hub 1 Balai Besar Standardisasi dan Pelayanan Jasa Industri Keramik dan Mineral Non-logam 1 Directorate of Research and Community Engagement, Universitas Indonesia 1 Fakultas Matematika dan Ilmu Pengetahuan Alam 1 ITB Journal Publisher, LPPM ITB more ... 1 Jurnal Eksakta 1 Universitas Jenderal Soedirman less ...

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