Telluride is a truly special place. Here the natural beauty can be combined with
a large dose of science thanks to TSRC. I had a great time at Telluride
School of Theoretical Chemistry-2019! Suri
Vaikuntanathan told us about master equations, out-of equilibrium
phenomena and Langevin equation in overdamped limit. Tim
Berkelbach did a terrific job with HF, full and truncated CI, MP-theory
(especially the diagrams), topped with CC (of course no DFT). Ignacio
Franco managed to squeeze all of quantum dynamics, and Michael Feig
covered all one needs to know about Force Fields, MD, modelling at different
levels of coarse-graining and enhanced sampling techniques. Wrapping up the
school with a 9-hour hike, I came back with new friends, fond memories, useful
knowledge and amazing pictures.
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June 17 - June 21
Miller Group goes to Yosemite
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An awesome summer group trip to the Yosemite
and Sequoia national parks.
We saw it all: bears, deer, giant trees, big waterfalls and the glory of Yosemite from atop the famous
Half Dome after 5 hours of hiking.
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January 11-13
Berkeley Statistical Mechanics Meeting
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This is my first time at the annual Berkeley Statistical Mechanics
Meeting. For the Miller group, however, attending this conference has
been an established tradition. Great science, interesting people, lovely nature
- it was a great one!
It's official!!! I am a member of the Miller group.
Time to start real work!
November 24
Holodomor remembrance
Every year in the evening of the fourth Saturday of November Ukrainians
light a candle on their window porch and remember. We commemorate the
deaths of 3-10 million people (according to different estimates) in a
purposefully inflicted famine (named Holodomor) under
the rule of Stalin in 1932-33. My candle was lit this year, I grieve and
remember.
November 3
Ukrainian-Brazilian festival
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Shortly after getting to South California, I reached out to connect to
active Ukrainians in the area and found myself as a performer at the
Ukrainian-Brazilian festival, organized by Natalia Godzhik.
Here is an amateur video of the short
performance
October 14
Fabulous Fall Flying Fair
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A month after joining Caltech I took the opportunity to try how flying a
small plane fells. The trial run with an experienced pilot was offered
by AACIT as part of their Fabulous Fall
Flying Fair. So cool!
September 18
Started at Caltech
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And so my scientific journey continues, now at Caltech in Southern
California, USA
FRI (Foundation of Regional Initiatives)
is a Ukrainian youth organization. This year they organized a 5-day Media camp at
the St. Luka lake, Ukraine. Seminars and Practicals covered: journalism,
fake news, SMM, photography, and creative writing.
Presenting a poster "Charge transport in DNA: From Comprehensive Simulations
to Key Principles" at the 28th Canadian Symposium on Theoretical
and Computational Chemistry. People enjoyed listening about our extension of
Landauer-Buttiker probes with Neural Networks.
June 15
Finally a proud UofT Graduate
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May 27
Desna Year end Performance
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Desna Ukrainian dance company is
training a new generation of dancers in the Desna school. Kids have a
yearly performance to showcase their achievements and invite the company
to perform. This year the company performed two non-Ukrainian dances: Gypsy and Country.
May 26
Vyshyvanka day in Toronto
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Vyshyvanka
day 2018 in Toronto. This holiday is a celebration of a
traditional Ukrainian embroidered shirt, called "Vyshyvanka"
Enjoying a fantastic hike with Caltech professors and students during the
Graduate recruitment weekend and enjoying great conversations with
Professors Thomas
Miller, Garnet
Chan and William
Goddard
Received a warm e-mail from the chair of the chemistry graduate admissions
and an awesome chemical theorist Thomas F. Miller III
welcoming me to Caltech! So excited =)
Scientific advances
July 15, 2019
Are many modern DFT calculations wrong?
Andrea Bootsma and Steven Wheeler
found that free energies for some isomerizations, torsional barriers, and
regio- and stereoselective reactions depend on how the molecule is
positioned on the grid due to lack of rotational invariance on a finite
grid. The errors can be mitigated using a dense grid, but many standard DFT
calculation results need to be questioned. The article hasn't appeared in
the journal, but here is the Chemrxiv
link
November 26, 2018
Fathers can also pass mitochondrial DNA to their offsprings
Mitochondrial genome was thought to be inherited exclusively from the mother.
However, a recent study
published in PNAS uncovered multiple instances of biparental
inheritance.
October 29, 2018
U2 molecule loses its bond due to relativity
Recent
calculation of the diuranium molecule revealed that the bond between
the two atoms is not quintuple. The molecule was first observed
experimentally in 1974,
and was
calculated to have a quintuple bond using CAS-SCF in 2005. The newer
calculation considers relativistic effects more carefully and comes to the
conclusion that the bond in diuranium is, after all, quadruple.
August 2, 2017
Antihydrogen hyperfine spectrum
First measurement
of the splitting in the antihydrogen, an anti-matter analogue of atomic
hydrogen finds the hyperfine splittings to be the same at the level of four
parts in 10,000. These observations are crucial for a deeper understanding
of fundamental symmetries. However, we are still a long way from answering
"Why is there more matter than antimatter in the observable universe" with a
high degree of confidence.