Debmalya Ray Profile
Debmalya Ray

@Debmalya_UMN

Followers
567
Following
6K
Statuses
406

Computational Chemist. Photovoltaic materials, metal organic framework, actinide chemistry, electrochemistry, carbon capture and conversion.Currently at ORNL.

Knoxville, TN
Joined May 2016
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@Debmalya_UMN
Debmalya Ray
1 month
@CorinWagen 24/30. Interestingly all the six I got wrong are real functionals that I never heard of 😀
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@Debmalya_UMN
Debmalya Ray
2 months
RT @olexandr: This is what happens when you let computer scientists design molecules 🤯 Oral presentation @NeurIPSConf #NeurIPS2024 https://…
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@Debmalya_UMN
Debmalya Ray
3 months
@ItaiYanai Most successful grants were submitted on April Fools day (04/01). Clearly they managed to fool the reviewers 😀😀😀
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@Debmalya_UMN
Debmalya Ray
3 months
@TEAS_Actinides I was really excited to see this today. Glad to see our theoretical prediction was correct.
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@Debmalya_UMN
Debmalya Ray
3 months
Here is a link to our work in inorganic chemistry @meaganoakley @arup_chemistry @gagliardi8
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@Debmalya_UMN
Debmalya Ray
4 months
Here is our latest work on entropy driven selective binding of dihydrogen phosphate over nitrate using hybrid calixpyrrole-azacrown hybrid ligands.
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@Debmalya_UMN
Debmalya Ray
4 months
@MaximZiatdinov Yeah. Wine is good. I miss the breweries in Richland area.
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@Debmalya_UMN
Debmalya Ray
4 months
@YuanyueL @ACSCOMP @ACSCATLDivision This is great and very useful.
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@Debmalya_UMN
Debmalya Ray
4 months
@RandallSnurr Following for advice.
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@Debmalya_UMN
Debmalya Ray
6 months
This is relatable.
Tweet media one
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@Debmalya_UMN
Debmalya Ray
6 months
Here is our work with @JLsessler on thermally driven catch and release of CoCl2 now published in @J_A_C_S
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@Debmalya_UMN
Debmalya Ray
7 months
Here is our latest work on molten salt chemistry in @J_A_C_S. Glad to explore another new field of research as a part of my postdoctoral training at Oak Ridge National Laboratory.
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@Debmalya_UMN
Debmalya Ray
7 months
@ProfvLilienfeld @acceleration_c @UofT @VectorInst Interested. Sent you email. DM didn’t work.
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@Debmalya_UMN
Debmalya Ray
7 months
Here is my latest paper on nature communication on polyolefin deconstruction.
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@Debmalya_UMN
Debmalya Ray
8 months
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@Debmalya_UMN
Debmalya Ray
8 months
@joaquinbarroso I see. Earlier they used to have input file examples in their webpage. Now they made it fully GUI based.
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@Debmalya_UMN
Debmalya Ray
8 months
@OmarFarha5 @GenzLab Often computational folks are criticized for collaborating too much with experimentalists.
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