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Journal of computational chemistry, ISSN 0192-8651, 2013, Volume 34, Issue 16, pp. 1429 - 1437
We describe principal features of the newly released version, NBO 6.0, of the natural bond orbital analysis program, that provides novel “link‐free... 
wavefunction analysis | chemical bonding interactions | natural bond orbital | ENERGY DECOMPOSITION ANALYSIS | RESONANCE THEORY | CHEMISTRY, MULTIDISCIPLINARY | Quantum Theory | Software | Algorithms
Journal Article
Physical chemistry chemical physics : PCCP, ISSN 1463-9084, 2018, Volume 20, Issue 20, pp. 13792 - 13809
Journal Article
Computational materials science, ISSN 0927-0256, 10/2017, Volume 138, pp. 426 - 434
[Display omitted] •The new scheme preserves ortho-normality even together with absorbing bounds.•In standard TDDFT with absorbing boundary conditions,... 
Natural basis | Photoelectron spectra | TDDFT | Absorbing bounds | STOCHASTIC TDHF | LASER-PULSES | ENERGY | STATES | MATERIALS SCIENCE, MULTIDISCIPLINARY | DYNAMICS | SYSTEMS | METAL-CLUSTERS | DENSITY-FUNCTIONAL THEORY | EQUATION | PHOTOELECTRON-SPECTROSCOPY | Physics
Journal Article
Proceedings of the National Academy of Sciences - PNAS, ISSN 1091-6490, 2015, Volume 112, Issue 12, pp. E1406 - E1413
Fluctuating climate is a hallmark of Earth. As one transcends deep into Earth time, however, both the evidence for and the causes of climate change become... 
ITCZ | Milankovitch | Mesoproterozoic | Hadley cell | Xiamaling | ORGANIC-CARBON BURIAL | DEPOSITION | MULTIDISCIPLINARY SCIENCES | RECORD | XIAMALING FORMATION | VARIABILITY | NORTH-ATLANTIC | DYNAMICS | MAGNETITE | Hadley Cell | CARIACO BASIN | HISTORY | Climatic changes | Natural history | Research | Physical Sciences | PNAS Plus
Journal Article
Neurosurgery clinics of North America, ISSN 1042-3680, 07/2015, Volume 26, Issue 3, pp. 463 - 472
Journal Article