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Journal of Chemical Theory and Computation, ISSN 1549-9618, 01/2018, Volume 14, Issue 1, pp. 166 - 179
The accurate description of magnetic level energetics in oligonuclear exchange-coupled transition-metal complexes remains a formidable challenge for quantum... 
OXYGEN-EVOLVING COMPLEX | BINUCLEAR COMPLEXES | TRANSITION-METAL-COMPLEXES | AB-INITIO | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | PHOTOSYSTEM-II | CHEMISTRY, PHYSICAL | BASIS-SETS | MAGNETIC-PROPERTIES | FUNCTIONAL CALCULATIONS | HEISENBERG EXCHANGE | BROKEN SYMMETRY APPROACH
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 01/2018, Volume 14, Issue 1, p. 166
The accurate description of magnetic level energetics in oligonuclear exchange-coupled transition-metal complexes remains a formidable challenge for quantum... 
Antiferromagnetism | Perturbation theory | Exchanging | Quantum chemistry | Configuration interaction | Parameter identification | Biomimetics | Completeness | Orbital stability | Ligands | Coupling | Coordination compounds | Subspaces | Manganese
Journal Article
Journal Article
Journal of chemical theory and computation, 12/2017
The accurate description of magnetic level energetics in oligonuclear exchange-coupled transition metal complexes remains a formidable challenge for quantum... 
Journal Article
CHEMISTRY-A EUROPEAN JOURNAL, ISSN 0947-6539, 2007, Volume 13, Issue 24, pp. 6967 - 6974
bstraction of a Cl- ion from the P-chlorophospholes, R(4)C(4)pCl (R=Me, Et), produced the P-P bonded cations [R4C4P-P(Cl)C4R4](+), which reacted with PPh, to... 
cations | AB-INITIO | STABLE CARBENES | MAIN-GROUP | COMPLEXES | LIGAND-EXCHANGE | ION | CHEMISTRY, MULTIDISCIPLINARY | PHOSPHORUS CATIONS | density functional calculations | HETEROCYCLES | CHEMISTRY | carbene homologues | structure elucidation | phosphorus | ACCEPTOR
Journal Article
Biophysical Journal, ISSN 0006-3495, 01/2010, Volume 98, Issue 3, p. 127
Journal Article
Journal of Physical Chemistry A, ISSN 1089-5639, 06/2019, Volume 123, Issue 24, pp. 5081 - 5090
The variation in the singlet-triplet energy gap of diphenylcarbene (DPC) upon interaction with hydrogen (water and methanol) or halogen bond (XCF3, X = Cl, Br,... 
ENERGY | DIPHENYLCARBENE | DISPERSION | AB-INITIO | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | SINGLET-TRIPLET INTERCONVERSION | CHEMISTRY, PHYSICAL | BASIS-SETS | BONDED COMPLEXES | N-HETEROCYCLIC CARBENES | SOLVATION | SOLVENT
Journal Article
CHEMISTRY OF MATERIALS, ISSN 0897-4756, 06/2003, Volume 15, Issue 12, pp. 2299 - 2299
A new route for the preparation of SBA-1 mesoporous silica is being reported. The method, employs polyacrylic acid, which has the ability to form highly... 
PHASES | MATERIALS SCIENCE, MULTIDISCIPLINARY | CHEMISTRY, PHYSICAL | MOLECULAR-SIEVES
Journal Article
Aids, ISSN 0269-9370, 10/2014, Volume 28, Issue 16, pp. 2461 - 2473
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 05/2006, Volume 128, Issue 19, pp. 6376 - 6390
A series of new palladium dinuclear species with general formula [Pd2X(μ-X){μ- P t Bu2(Bph-R)}] (X = Cl, Br; Bph = biphenyl; R = H, Me, NMe2) have been... 
HIGH-ACTIVITY CATALYSTS | CROSS-COUPLING REACTIONS | EFFICIENT CATALYST | MOLECULAR-ORBITAL METHODS | C-N | ALPHA-ARYLATION | REACTIVITY | BOND | CHEMISTRY, MULTIDISCIPLINARY | SUZUKI-MIYAURA | HALIDE-COMPLEXES | Aromatic compounds | Palladium | Chemical properties
Journal Article
DALTON TRANSACTIONS, ISSN 1477-9226, 2004, Issue 14, pp. 2080 - 2086
The relative stabilities of different isomers of the isoelectronic series CnHnP5-n+ have been investigated using G3X theory. The results indicate that all... 
ANTIAROMATICITY | AROMATICITY | STATES | POLYTOPAL REARRANGEMENTS | CHEMICAL-SHIFTS | LASER-ABLATION | NIDO-5-VERTEX CLUSTERS | (CH)5 | CYCLOPENTADIENYL CATION | PYRAMIDAL CLUSTERS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Neuro-Oncology, ISSN 1522-8517, 11/2013, Volume 15, Issue suppl 3, pp. iii12 - iii31
Journal Article
Journal of the International AIDS Society, ISSN 1758-2652, 07/2016, Volume 19, Issue 6 Suppl 5, pp. 21264 - n/a
Journal Article
MICROPOROUS AND MESOPOROUS MATERIALS, ISSN 1387-1811, 11/2003, Volume 66, Issue 1, pp. 37 - 51
In this work we describe the synthesis of a variety of MCM-41 type hexagonal and SBA-1 type cubic mesostructures and mesoporous silicious materials employing a... 
mesoporous materials | MESOPOROUS MOLECULAR-SIEVES | MATERIALS SCIENCE, MULTIDISCIPLINARY | CHEMISTRY, PHYSICAL | hybrid materials | polyacrylic acid-surfactant ccmplexes | CHEMISTRY, APPLIED | self-organized systems
Journal Article
by Kobayashi, J and Yoshida, M and Tarui, S and Hirata, M and Takahashi, K and Naruse, K and Kasahara, S and Sano, S and Oh, H and Halbach, M and Peinkofer, G and Baumgartner, S and Krausgrill, B and Fatima, A and Hescheler, J and Saric, T and Mueller-Ehmsen, J and Kamakura, T and Makiyama, T and Sasaki, K and Hattori, T and Ohno, S and Yoshida, Y and Horie, M and Kimura, T and Guan, K and Streckfuss-Boemeke, K and Wolf, F and Azizian, A and Stauske, M and Tiburcy, M and Wagner, S and Maier, L. S and Zimmermann, W. H and Hasenfuss, G and Mehta, A and Sequiera, G. L and Sudibyo, Y and Jun, L and Wong, P and Liew, R and Shim, W and Dambrot, C and Braam, S. R and Freund, C. M. A. H and Van De Pas, S and Ward-Van Oostwaard, D and Atsma, D. E and Mummery, C. L and Shigeta, T and Kureishi Bando, Y and Aoyama, M and Monji, A and Mitsui, T and Cheng, X. W and Murohara, T and Saikawa, T and Nishio, S and Takahashi, N and Thuc, L. C and Saito, S and Fukui, A and Kume, O and Hara, M and Nakagawa, M and Teshima, Y and Radovits, T and Olah, A and Nemeth, B and Hidi, L and Birtalan, E and Kokeny, G and Szabo, G and Merkely, B and Rottlaender, D and Wolny, M and Motloch, L. J and Gebing, T and Reda, S and Hoppe, U. C and Feijoo-Bandin, S and Rodriguez-Penas, D and Garcia-Rua, V and Otero, M. F and Mosquera-Leal, A and Gonzalez-Juanatey, J. R and Lago, M. F and Dimitriadis, K and Tsioufis, C and Tsiachris, D and Kasiakogias, A and Psaltopoulou, T and Tzamou, V and Mazaraki, A and Andrikou, I and Pitsavos, C and Stefanadis, C and Mill, J. G and Rodrigues, S. L and Baldo, M. P and ... and on behalf of IRTG - 1566 PROMISE and on behalf of The SAVIOR investigators and on behalf of On behalf of the PLATelet inhibition and patient Outcomes (PLATO) investigators and on behalf of EPES Acute Cardiac Care group and on behalf of WHICH? Trial Investigators and on behalf of Prof. Geibel. PD Dr. Harloff, Dr. Guenther and on behalf of Italian ClinicalService Project and on behalf of PL-ACS Invaestigators and on behalf of EmbraceAC Study Group and on behalf of CHFN and on behalf of The interventional working group of the lebanese society of cardiology and on behalf of SAFETY Investigators and on behalf of grant of IGA Ministry of health of the Czech Republic no. NS9824-4/2008 and on behalf of the Korean Hypertension Research Network and on behalf of Jian-Jun Li and on behalf of the FRANCE2 steering Committee and on behalf of Cardiology&Development and on behalf of St. Antonius center for platelet function research and on behalf of the MANTRA Study investigators and on behalf of ROCKET AF Executive Committee and on behalf of Tako tsubo Italian Network and on behalf of the AF meta-analysis team and on behalf of Ibaraki Coronary Artery Disease Study (ICAS) registry and on behalf of ICALOR and on behalf of MANTRA Study Investigators and on behalf of Competence Network Heart Failure Germany and on behalf of APPRAISE-2 Study Group and on behalf of Sapaldia Study Group and on behalf of CHF-HOT Study and on behalf of CAPIRE Investigators and on behalf of Francesco Barilla, et al and on behalf of VIDA-IC investigators and on behalf of The BETTER-CARE Study Investigators and on behalf of BMIR and on behalf of The International Registry of Acute Aortic Dissection (IRAD) and on behalf of Francesca Frexia and on behalf of VIDA IC investigators and on behalf of FAST-MI 2010 and on behalf of Hypersleep and on behalf of ACTION and on behalf of SHIFT echostudy and on behalf of Korea Acute Myocardial Infarction Registry and on behalf of Barbanza investigators and on behalf of The GARFIELD Investigators and on behalf of the CHOICE trial investigators and on behalf of NIPPON DATA80/90 Research Group and on behalf of MINAP Steering Group and on behalf of PROTECT investigators and on behalf of TuePic and on behalf of Center for Clinical Heart Research, Oslo University Hospital, Ullevaal and on behalf of PROTECTION IV investigators and on behalf of ASAP Investigators and on behalf of FP7 project and on behalf of GARFIELD Investigators and on behalf of LIPID study investigators and on behalf of NIPPON DATA 80 Research Group and on behalf of COACH and on behalf of INH and on behalf of CARDIO-ARSIF registry and on behalf of Hopital Cardiologique, CIC a thematique cardiovasculaire CIC-005 INSERM, Universite Victor Segalen, CHU de Bordeaux, Bordeaux, France and on behalf of Registry of Cardiovascular Interventions, Czech Republic and on behalf of INPETU and on behalf of The International Registry of Acute Aortic Dissection and on behalf of the FAST-MI 2010 investigators and on behalf of PL-ACS Invastigators and on behalf of The Austrian Acute PCI Investigators and on behalf of Competence Network Heart Failure and on behalf of Thyroid Studies Collaboration and on behalf of University Centre for Cardiovascular Science and on behalf of SCAAR-registry and on behalf of BASKET/BASKET-PROVE Investigators and on behalf of Cardiac and on behalf of on behalf of the German Competence Network Heart Failure and the German Competence Network for HIV/AIDS and on behalf of Northern Iwate Heart Disease Registry Consortium and on behalf of J-MELODIC Investigators and on behalf of nil and on behalf of German Competence Network Heart Failure and on behalf of ARISTOTLE Investigators and on behalf of NA and on behalf of Popovici M
European Heart Journal, ISSN 0195-668X, 08/2012, Volume 33, Issue suppl 1, pp. 19 - 338
Journal Article
Measurement, ISSN 0263-2241, 12/2014, Volume 58, pp. 335 - 341
Short tubes with diameters of the order of 200 nm were drilled into silicon nitride (Si N ) membranes of 200 nm thickness by focused ion beam technology and... 
Si3N4 | DSMC | Focused ion beam | AFM | Standard leak | SEM | Nanotechnology | Gas flow meter | Leak rate measurement | Vacuum metrology | STEM | Si | N | GAS FLOWMETER | SIMULATION | FLOW | INSTRUMENTS & INSTRUMENTATION | ENGINEERING, MULTIDISCIPLINARY
Journal Article
IEEE Communications Surveys & Tutorials, ISSN 1553-877X, 2013, Volume 15, Issue 2, pp. 551 - 591
The distributed nature and dynamic topology of Wireless Sensor Networks (WSNs) introduces very special requirements in routing protocols that should be met.... 
Wireless communication | Wireless sensor networks | Energy consumption | Routing | Routing protocols | Sensors | Energy Efficiency | Routing Protocols | Wireless Sensor Networks | ISSUES | DESIGN | CONSERVATION | BROADCAST | COMPUTER SCIENCE, INFORMATION SYSTEMS | TELECOMMUNICATIONS | PERFORMANCE EVALUATION | DELIVERY
Journal Article
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