| 1 |
Thermal Stability of Bis-Tetrazole and Bis-Triazole Derivatives with Long Catenated Nitrogen Chains: Quantitative Insights from High-Level Quantum Chemical Calculations
Gorn MV, Gritsan NP, Goldsmith CF, Kiselev VG
Journal of Physical Chemistry A, 124(38), 7665, 2020 |
| 2 |
Accurate Prediction of Bond Dissociation Energies and Barrier Heights for High-Energy Caged Nitro and Nitroamino Compounds Using a Coupled Cluster Theory
Kiselev VG, Goldsmith CF
Journal of Physical Chemistry A, 123(23), 4883, 2019 |
| 3 |
Accurate Thermochemistry of Novel Energetic Fused Tricyclic 1,2,3,4-Tetrazine Nitro Derivatives from Local Coupled Cluster Methods Vitaly
Kiselev VG, Goldsmith CF
Journal of Physical Chemistry A, 123(45), 9818, 2019 |
| 4 |
Decomposition Pathways of Titanium Isopropoxide (Ti(OiPr)4): New Insights from UV-Photodissociation Experiments and Quantum Chemical Calculations
Ershov KS, Kochubei SA, Kiselev VG, Baklanov AV
Journal of Physical Chemistry A, 122(4), 1064, 2018 |
| 5 |
Thermochemistry, Tautomerism, and Thermal Decomposition of 1,5-Diaminotetrazole: A High-Level ab Initio Study
Shakhova MV, Muravyev NV, Gritsan NP, Kiselev VG
Journal of Physical Chemistry A, 122(15), 3939, 2018 |
| 6 |
Comment on "Studies on Thermodynamic Properties of FOX-7 and Its Five Closed-Loop Derivatives"
Muravyev NV, Pivkina AN, Kiselev VG
Journal of Chemical and Engineering Data, 62(1), 575, 2017 |
| 7 |
Cheaper, Faster, or Better: Are simple estimations of safety parameters of hazardous materials reliable? Comments on "Thermal behaviors, nonisothermal decomposition reaction kinetics, thermal safety and burning rates of BTATz-CMDB propellant" by Zhao et al. (2010)
Muravyev NV, Kiselev VG
Journal of Hazardous Materials, 334, 267, 2017 |
| 8 |
Comment on "Computational Study on the Vinyl Azide Decomposition"
Nguyen MT, Hang TD, Gritsan NP, Kiselev VG
Journal of Physical Chemistry A, 119(51), 12906, 2015 |
| 9 |
Molecular organization in the thin films of gallium(III) phthalocyanine chloride and its mu-(oxo) dimer: Optical spectroscopy and XPS study
Basova TV, Kiselev VG, Latteyer F, Peisert H, Chasse T
Applied Surface Science, 322, 242, 2014 |
| 10 |
Unexpected Primary Reactions for Thermolysis of 1,1-Diamino-2,2-dinitroethylene (FOX-7) Revealed by ab Initio Calculations
Kiselev VG, Gritsan NP
Journal of Physical Chemistry A, 118(36), 8002, 2014 |
